*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1a95_c00 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 1 4 # 1 C 88 ASP A 16 ASP^? 19.84 O2 SO4 A 201 C 89 ASP A 18 ASP.? 23.99 O2 SO4 A 201 C 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 C 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 35.82 109.51 58.11 36.79 111.39 58.16 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 34.50 112.32 53.52 36.24 113.36 54.10 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 44.76 111.03 53.07 46.05 111.62 51.50 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 43.88 105.59 49.49 44.98 111.77 48.53 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 4 1a95_c00 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 2 4 # 2 C 88 ASP A 18 ASP.? 23.99 O2 SO4 A 201 C 89 ASP A 16 ASP^? 19.84 O2 SO4 A 201 C 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 C 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 35.82 109.51 58.11 36.79 111.39 58.16 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 34.50 112.32 53.52 36.24 113.36 54.10 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 44.76 111.03 53.07 46.05 111.62 51.50 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 43.88 105.59 49.49 44.98 111.77 48.53 46.06 42.14 -21.13 50.44 45.35 -19.26 1a95_c00 source 1a95 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSFERASE : 2 hits 1a95_c00 naa= 4 ULMN 4 1a95_c01 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 1 4 # 1 A 88 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 89 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 28.94 110.40 17.72 27.05 109.42 17.78 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 27.21 110.68 22.97 26.09 108.99 22.41 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 28.82 100.59 20.87 28.57 98.90 22.12 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 34.37 100.82 23.64 28.36 99.87 25.42 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 4 1a95_c01 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 2 4 # 2 A 88 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 89 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 28.94 110.40 17.72 27.05 109.42 17.78 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 27.21 110.68 22.97 26.09 108.99 22.41 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 28.82 100.59 20.87 28.57 98.90 22.12 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 34.37 100.82 23.64 28.36 99.87 25.42 46.06 42.14 -21.13 50.44 45.35 -19.26 1a95_c01 source 1a95 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSFERASE : 2 hits 1a95_c01 naa= 4 ULMN 4 1a95_c02 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 1 4 # 1 B 88 ASP A 16 ASP^? 19.84 O2 SO4 A 201 B 89 ASP A 18 ASP.? 23.99 O2 SO4 A 201 B 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 B 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 15.87 130.02 20.98 17.78 130.94 20.91 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 18.52 128.66 25.62 19.66 130.36 25.09 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 17.38 138.95 26.03 17.97 140.13 27.68 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 11.86 138.01 29.49 18.01 139.06 30.49 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 4 1a95_c02 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 2 4 # 2 B 88 ASP A 18 ASP.? 23.99 O2 SO4 A 201 B 89 ASP A 16 ASP^? 19.84 O2 SO4 A 201 B 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 B 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 15.87 130.02 20.98 17.78 130.94 20.91 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 18.52 128.66 25.62 19.66 130.36 25.09 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 17.38 138.95 26.03 17.97 140.13 27.68 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 11.86 138.01 29.49 18.01 139.06 30.49 46.06 42.14 -21.13 50.44 45.35 -19.26 1a95_c02 source 1a95 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSFERASE : 2 hits 1a95_c02 naa= 4 ULMN 4 1a95_c03 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 1 4 # 1 D 88 ASP A 16 ASP^? 19.84 O2 SO4 A 201 D 89 ASP A 18 ASP.? 23.99 O2 SO4 A 201 D 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 D 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 16.10 122.43 61.36 15.17 120.52 61.32 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 16.52 120.83 56.08 14.84 119.68 56.64 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 6.41 122.44 58.21 4.75 122.21 56.90 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 6.66 128.09 55.52 5.74 122.11 53.55 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 4 1a95_c03 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSuser 2 4 # 2 D 88 ASP A 18 ASP.? 23.99 O2 SO4 A 201 D 89 ASP A 16 ASP^? 19.84 O2 SO4 A 201 D 92 ASP B 166 ASP.? 24.89 O2 SO4 A 201 D 115 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 16.10 122.43 61.36 15.17 120.52 61.32 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 16.52 120.83 56.08 14.84 119.68 56.64 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 6.41 122.44 58.21 4.75 122.21 56.90 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 6.66 128.09 55.52 5.74 122.11 53.55 46.06 42.14 -21.13 50.44 45.35 -19.26 1a95_c03 source 1a95 XANTHINE-GUANINE PHOSPHORIBOSYLTRANSFERASE : 2 hits 1a95_c03 naa= 4 ULMN 4 1akm_c03 ORNITHINE TRANSCARBAMYLASE user 1 4 # 1 A 57 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 58 THR A 36 THR~? 28.00 CL CL B 203 A 106 ARG A 31 ARG^? 24.05 CL CL B 203 A 133 HIS A 32 HIS.? 29.45 CL CL B 203 coo 37.17 69.43 16.95 39.61 69.29 18.96 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 31.76 68.35 14.99 32.00 68.70 12.89 6.76 39.13 -20.62 6.63 40.45 -22.30 coo 33.87 66.22 9.96 35.73 68.37 10.99 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 35.28 73.60 8.07 35.11 72.84 9.96 3.09 41.50 -11.72 1.06 42.02 -11.62 ULMN 4 1akm_c03 ORNITHINE TRANSCARBAMYLASE user 2 4 # 2 A 57 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 58 THR B 36 THR~? 34.43 O4 SO4 B 202 A 106 ARG B 31 ARG^? 34.85 CL CL B 203 A 133 HIS B 32 HIS.? 32.94 O4 SO4 B 202 coo 37.17 69.43 16.95 39.61 69.29 18.96 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 31.76 68.35 14.99 32.00 68.70 12.89 60.36 24.94 -17.76 60.17 23.61 -19.48 coo 33.87 66.22 9.96 35.73 68.37 10.99 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 35.28 73.60 8.07 35.11 72.84 9.96 63.63 22.26 -8.79 65.59 21.52 -8.60 1akm_c03 source 1akm ORNITHINE TRANSCARBAMYLASE : 2 hits 1akm_c03 naa= 4 ULMN 4 1akm_c04 ORNITHINE TRANSCARBAMYLASE user 1 4 # 1 B 57 ARG A 39 ARG~? 27.60 O2 SO4 A 201 B 58 THR A 36 THR~? 28.00 CL CL B 203 B 106 ARG A 31 ARG^? 24.05 CL CL B 203 B 133 HIS A 32 HIS.? 29.45 CL CL B 203 coo 31.47 45.08 32.03 31.41 42.08 31.00 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 30.01 50.73 32.15 31.74 51.62 33.16 6.76 39.13 -20.62 6.63 40.45 -22.30 coo 35.62 52.37 31.71 35.46 49.72 33.20 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 36.28 50.33 39.07 34.91 49.66 37.71 3.09 41.50 -11.72 1.06 42.02 -11.62 ULMN 4 1akm_c04 ORNITHINE TRANSCARBAMYLASE user 2 4 # 2 B 57 ARG B 39 ARG~? 27.56 O4 SO4 B 202 B 58 THR B 36 THR~? 34.43 O4 SO4 B 202 B 106 ARG B 31 ARG^? 34.85 CL CL B 203 B 133 HIS B 32 HIS.? 32.94 O4 SO4 B 202 coo 31.47 45.08 32.03 31.41 42.08 31.00 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 30.01 50.73 32.15 31.74 51.62 33.16 60.36 24.94 -17.76 60.17 23.61 -19.48 coo 35.62 52.37 31.71 35.46 49.72 33.20 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 36.28 50.33 39.07 34.91 49.66 37.71 63.63 22.26 -8.79 65.59 21.52 -8.60 1akm_c04 source 1akm ORNITHINE TRANSCARBAMYLASE : 2 hits 1akm_c04 naa= 4 ULMN 4 1akm_c05 ORNITHINE TRANSCARBAMYLASE user 1 4 # 1 C 57 ARG A 39 ARG~? 27.60 O2 SO4 A 201 C 58 THR A 36 THR~? 28.00 CL CL B 203 C 106 ARG A 31 ARG^? 24.05 CL CL B 203 C 133 HIS A 32 HIS.? 29.45 CL CL B 203 coo 22.08 47.45 4.33 23.58 48.95 2.06 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 19.99 47.16 9.87 19.96 45.01 10.26 6.76 39.13 -20.62 6.63 40.45 -22.30 coo 23.22 42.51 11.24 22.66 42.44 8.27 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 18.34 38.49 6.81 18.75 40.50 6.70 3.09 41.50 -11.72 1.06 42.02 -11.62 ULMN 4 1akm_c05 ORNITHINE TRANSCARBAMYLASE user 2 4 # 2 C 57 ARG B 39 ARG~? 27.56 O4 SO4 B 202 C 58 THR B 36 THR~? 34.43 O4 SO4 B 202 C 106 ARG B 31 ARG^? 34.85 CL CL B 203 C 133 HIS B 32 HIS.? 32.94 O4 SO4 B 202 coo 22.08 47.45 4.33 23.58 48.95 2.06 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 19.99 47.16 9.87 19.96 45.01 10.26 60.36 24.94 -17.76 60.17 23.61 -19.48 coo 23.22 42.51 11.24 22.66 42.44 8.27 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 18.34 38.49 6.81 18.75 40.50 6.70 63.63 22.26 -8.79 65.59 21.52 -8.60 1akm_c05 source 1akm ORNITHINE TRANSCARBAMYLASE : 2 hits 1akm_c05 naa= 4 ULMN 4 1bbs_c10 RENIN user 1 4 # 1 32 ASP A 165 ASP.? 13.91 CL CL B 203 33 THR A 151 THR^? 5.27 CL CL B 203 215 ASP A 147 ASP.? 14.36 CL CL B 203 218 ALA A 146 ALA.? 18.24 CL CL B 203 coo 61.19 45.85 78.73 62.86 45.48 77.48 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 62.61 41.50 79.97 61.55 39.62 79.92 23.61 29.36 -14.77 24.70 27.83 -13.70 coo 63.61 40.10 74.06 64.05 42.07 74.70 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 61.04 42.48 71.22 62.11 41.40 71.19 15.11 31.88 -19.73 13.75 32.44 -20.04 1bbs_c10 source 1bbs RENIN : 1 hits 1bbs_c10 naa= 4 ULMN 4 1bbs_c11 RENIN user 1 4 # 1 32 ASP A 165 ASP.? 13.91 CL CL B 203 33 THR A 151 THR^? 5.27 CL CL B 203 215 ASP A 147 ASP.? 14.36 CL CL B 203 218 ALA A 146 ALA.? 18.24 CL CL B 203 coo 61.19 45.85 78.73 62.86 45.48 77.48 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 62.61 41.50 79.97 61.55 39.62 79.92 23.61 29.36 -14.77 24.70 27.83 -13.70 coo 63.61 40.10 74.06 64.05 42.07 74.70 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 61.04 42.48 71.22 62.11 41.40 71.19 15.11 31.88 -19.73 13.75 32.44 -20.04 1bbs_c11 source 1bbs RENIN : 1 hits 1bbs_c11 naa= 4 ULMN 4 1dl2_c00 CLASS I ALPHA-1,2-MANNOSIDASE user 1 4 # 1 A 132 GLU A 35 GLU.? 23.66 CL CL B 203 A 136 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 275 ASP A 64 ASP.? 24.79 O3 SO4 A 201 A 435 GLU A 66 GLU.? 18.87 O3 SO4 A 201 coo -6.23 53.40 -2.33 -7.38 55.09 -1.77 8.44 41.65 -17.02 9.96 41.64 -15.52 coo -4.99 57.22 1.82 -7.93 56.43 2.21 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -12.63 61.87 -10.13 -11.95 60.35 -8.79 5.36 51.73 -7.41 5.08 53.43 -6.17 coo -13.69 65.25 -3.58 -13.46 63.85 -2.01 10.83 52.69 -6.96 11.60 51.77 -5.23 ULMN 4 1dl2_c00 CLASS I ALPHA-1,2-MANNOSIDASE user 2 4 # 2 A 132 GLU A 35 GLU.? 23.66 CL CL B 203 A 136 ARG A 43 ARG~? 21.16 CL CL B 203 A 275 ASP A 64 ASP.? 24.79 O3 SO4 A 201 A 435 GLU A 66 GLU.? 18.87 O3 SO4 A 201 coo -6.23 53.40 -2.33 -7.38 55.09 -1.77 8.44 41.65 -17.02 9.96 41.64 -15.52 coo -4.99 57.22 1.82 -7.93 56.43 2.21 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -12.63 61.87 -10.13 -11.95 60.35 -8.79 5.36 51.73 -7.41 5.08 53.43 -6.17 coo -13.69 65.25 -3.58 -13.46 63.85 -2.01 10.83 52.69 -6.96 11.60 51.77 -5.23 1dl2_c00 source 1dl2 CLASS I ALPHA-1,2-MANNOSIDASE : 2 hits 1dl2_c00 naa= 4 ULMN 4 1f6d_c03 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 4 # 1 D 95 ASP A 65 ASP.? 22.23 O3 SO4 A 201 D 117 GLU A 83 GLU^? 22.48 O3 SO4 A 201 D 131 GLU A 66 GLU.? 18.87 O3 SO4 A 201 D 213 HIS A 32 HIS.? 29.45 CL CL B 203 coo 60.45 59.04 95.56 60.08 59.57 97.62 7.01 55.74 -9.90 7.72 56.49 -8.05 coo 53.51 54.68 98.43 54.65 55.64 99.96 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 62.34 62.21 97.48 63.80 63.61 98.07 10.83 52.69 -6.96 11.60 51.77 -5.23 coo 57.94 68.02 108.20 56.70 67.43 106.62 3.09 41.50 -11.72 1.06 42.02 -11.62 1f6d_c03 source 1f6d UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE : 1 hits 1f6d_c03 naa= 4 ULMN 4 1i8t_c02 UDP-GALACTOPYRANOSE MUTASE user 1 4 # 1 A 170 ARG A 110 ARG~? 42.02 CL CL B 203 A 278 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 298 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 348 ASP A 135 ASP~? 30.53 CL CL B 203 coo -23.99 -12.72 0.77 -26.03 -13.46 2.92 3.93 48.32 -34.88 2.67 46.51 -37.04 coo -18.98 -3.88 -14.05 -18.01 -5.56 -11.69 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -18.09 -5.55 -18.88 -17.66 -5.99 -16.85 13.06 47.55 -15.25 11.61 49.09 -15.60 coo -11.04 -13.38 -5.15 -13.10 -12.92 -5.14 16.71 44.39 -33.44 18.14 42.86 -33.63 ULMN 4 1i8t_c02 UDP-GALACTOPYRANOSE MUTASE user 2 4 # 2 A 170 ARG B 72 ARG^? 12.97 O1 SO4 B 202 A 278 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 298 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 348 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -23.99 -12.72 0.77 -26.03 -13.46 2.92 45.42 12.48 -0.13 47.39 14.66 0.83 coo -18.98 -3.88 -14.05 -18.01 -5.56 -11.69 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -18.09 -5.55 -18.88 -17.66 -5.99 -16.85 58.35 23.06 -14.04 56.92 23.13 -12.46 coo -11.04 -13.38 -5.15 -13.10 -12.92 -5.14 57.62 9.59 -5.23 56.36 8.07 -4.49 1i8t_c02 source 1i8t UDP-GALACTOPYRANOSE MUTASE : 2 hits 1i8t_c02 naa= 4 ULMN 4 1i8t_c03 UDP-GALACTOPYRANOSE MUTASE user 1 4 # 1 B 170 ARG B 72 ARG^? 12.97 O1 SO4 B 202 B 278 ARG B 39 ARG~? 27.56 O4 SO4 B 202 B 298 GLU B 35 GLU.? 28.14 O4 SO4 B 202 B 348 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -8.10 23.98 3.08 -8.58 21.04 2.27 45.42 12.48 -0.13 47.39 14.66 0.83 coo -19.09 15.00 16.26 -16.38 15.21 14.84 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -19.42 16.58 21.15 -18.01 16.20 19.59 58.35 23.06 -14.04 56.92 23.13 -12.46 coo -3.61 14.95 13.27 -5.31 15.62 12.23 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 4 1i8t_c03 UDP-GALACTOPYRANOSE MUTASE user 2 4 # 2 B 170 ARG B 90 ARG~? 30.02 O1 SO4 B 202 B 278 ARG B 39 ARG~? 27.56 O4 SO4 B 202 B 298 GLU B 35 GLU.? 28.14 O4 SO4 B 202 B 348 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -8.10 23.98 3.08 -8.58 21.04 2.27 58.35 -1.07 -14.14 58.36 -4.09 -13.55 coo -19.09 15.00 16.26 -16.38 15.21 14.84 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -19.42 16.58 21.15 -18.01 16.20 19.59 58.35 23.06 -14.04 56.92 23.13 -12.46 coo -3.61 14.95 13.27 -5.31 15.62 12.23 57.62 9.59 -5.23 56.36 8.07 -4.49 1i8t_c03 source 1i8t UDP-GALACTOPYRANOSE MUTASE : 2 hits 1i8t_c03 naa= 4 ULMN 4 1kzh_c00 PHOSPHOFRUCTOKINASE user 1 4 # 1 A 146 ARG A 31 ARG^? 24.05 CL CL B 203 A 203 LYS A 9 LYS^? 13.80 CL CL B 203 A 204 THR A 149 THR^? 9.97 CL CL B 203 A 206 ASP A 147 ASP.? 14.36 CL CL B 203 coo 25.62 33.56 45.31 27.90 32.69 47.16 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 38.37 29.68 45.64 33.70 31.88 45.68 17.34 32.48 -9.89 16.06 33.15 -4.52 coo 36.44 29.68 48.91 35.26 27.91 49.41 17.06 28.19 -12.48 17.57 26.94 -10.79 coo 33.39 27.17 52.78 32.04 28.76 52.44 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 4 1kzh_c00 PHOSPHOFRUCTOKINASE user 2 4 # 2 A 146 ARG B 31 ARG^? 34.85 CL CL B 203 A 203 LYS B 9 LYS^? 26.01 CL CL B 203 A 204 THR B 149 THR^? 27.09 CL CL B 203 A 206 ASP B 147 ASP.? 29.53 CL CL B 203 coo 25.62 33.56 45.31 27.90 32.69 47.16 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 38.37 29.68 45.64 33.70 31.88 45.68 50.82 33.22 -7.07 51.79 32.01 -1.71 coo 36.44 29.68 48.91 35.26 27.91 49.41 51.72 37.30 -9.59 51.54 39.31 -8.76 coo 33.39 27.17 52.78 32.04 28.76 52.44 52.99 37.46 -14.27 53.96 39.20 -13.53 1kzh_c00 source 1kzh PHOSPHOFRUCTOKINASE : 2 hits 1kzh_c00 naa= 4 ULMN 4 1kzh_c01 PHOSPHOFRUCTOKINASE user 1 4 # 1 B 146 ARG A 31 ARG^? 24.05 CL CL B 203 B 203 LYS A 9 LYS^? 13.80 CL CL B 203 B 204 THR A 149 THR^? 9.97 CL CL B 203 B 206 ASP A 147 ASP.? 14.36 CL CL B 203 coo 30.44 48.99 84.53 31.72 50.36 82.10 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 41.12 55.31 79.75 37.30 52.17 81.04 17.34 32.48 -9.89 16.06 33.15 -4.52 coo 38.33 54.75 77.25 36.67 56.16 77.22 17.06 28.19 -12.48 17.57 26.94 -10.79 coo 33.88 56.54 74.67 32.88 54.78 75.26 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 4 1kzh_c01 PHOSPHOFRUCTOKINASE user 2 4 # 2 B 146 ARG B 31 ARG^? 34.85 CL CL B 203 B 203 LYS B 9 LYS^? 26.01 CL CL B 203 B 204 THR B 149 THR^? 27.09 CL CL B 203 B 206 ASP B 147 ASP.? 29.53 CL CL B 203 coo 30.44 48.99 84.53 31.72 50.36 82.10 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 41.12 55.31 79.75 37.30 52.17 81.04 50.82 33.22 -7.07 51.79 32.01 -1.71 coo 38.33 54.75 77.25 36.67 56.16 77.22 51.72 37.30 -9.59 51.54 39.31 -8.76 coo 33.88 56.54 74.67 32.88 54.78 75.26 52.99 37.46 -14.27 53.96 39.20 -13.53 1kzh_c01 source 1kzh PHOSPHOFRUCTOKINASE : 2 hits 1kzh_c01 naa= 4 ULMN 4 1qrg_c00 CARBONIC ANHYDRASE user 1 4 # 1 A 62 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 75 GLN B 153 GLN^? 12.96 CL CL B 203 A 84 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 202 ASN A 13 ASN^? 10.47 CL CL B 203 coo 31.58 50.21 48.39 31.33 50.18 50.48 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 15.01 67.80 50.45 13.17 67.90 51.59 37.64 35.00 -16.91 36.16 34.05 -15.72 coo 31.72 45.69 48.66 33.65 44.89 48.92 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 11.82 69.95 45.33 12.39 70.17 47.37 30.72 33.91 -14.09 32.77 34.57 -14.11 1qrg_c00 source 1qrg CARBONIC ANHYDRASE : 1 hits 1qrg_c00 naa= 4 ULMN 4 1rne_c05 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 4 # 1 32 ASP A 136 ASP~? 33.35 CL CL B 203 35 SER A 109 SER~? 36.36 CL CL B 203 75 TYR A 107 TYR.? 29.41 CL CL B 203 215 ASP A 135 ASP~? 30.53 CL CL B 203 coo 11.85 17.24 72.81 11.09 15.37 72.36 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 12.20 12.71 75.45 13.69 13.84 74.03 11.05 47.60 -32.89 11.53 46.95 -35.16 coo 15.08 11.29 68.68 16.45 12.70 70.65 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 5.22 15.03 71.43 7.19 14.88 70.83 16.71 44.39 -33.44 18.14 42.86 -33.63 ULMN 4 1rne_c05 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 4 # 2 32 ASP B 136 ASP~? 35.38 CL CL B 203 35 SER B 109 SER~? 35.44 CL CL B 203 75 TYR B 107 TYR.? 30.85 O4 SO4 B 202 215 ASP B 135 ASP~? 30.33 CL CL B 203 coo 11.85 17.24 72.81 11.09 15.37 72.36 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 12.20 12.71 75.45 13.69 13.84 74.03 55.00 17.36 -30.57 53.91 19.30 -31.57 coo 15.08 11.29 68.68 16.45 12.70 70.65 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 5.22 15.03 71.43 7.19 14.88 70.83 49.61 21.30 -30.64 48.45 23.04 -30.81 1rne_c05 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c05 naa= 4 ULMN 4 2tpl_c02 TYROSINE PHENOL-LYASE user 1 4 # 1 A 71 TYR A 133 TYR^? 32.81 O4 SO4 A 201 A 123 PHE B 22 PHE^? 5.22 CL CL B 203 A 214 ASP A 24 ASP^? 8.56 CL CL B 203 A 381 ARG B 19 ARG.? 10.93 CL CL B 203 coo -18.26 14.59 1.38 -20.32 13.94 3.12 17.01 49.27 -30.66 15.25 47.83 -32.31 coo -30.08 -12.81 5.71 -28.04 -12.05 7.46 30.20 29.70 -11.84 28.90 29.99 -14.32 coo -29.95 -11.32 -1.46 -28.83 -11.55 0.31 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -28.50 -18.89 13.52 -29.04 -16.11 14.56 34.18 19.86 -14.65 35.93 20.77 -12.27 2tpl_c02 source 2tpl TYROSINE PHENOL-LYASE : 1 hits 2tpl_c02 naa= 4 ULMN 4 2tpl_c03 TYROSINE PHENOL-LYASE user 1 4 # 1 B 71 TYR A 133 TYR^? 32.81 O4 SO4 A 201 B 123 PHE B 22 PHE^? 5.22 CL CL B 203 B 214 ASP A 24 ASP^? 8.56 CL CL B 203 B 381 ARG B 19 ARG.? 10.93 CL CL B 203 coo -20.85 -10.53 13.88 -22.65 -9.60 11.98 17.01 49.27 -30.66 15.25 47.83 -32.31 coo -26.81 18.98 9.83 -25.06 17.93 7.94 30.20 29.70 -11.84 28.90 29.99 -14.32 coo -26.88 17.61 16.89 -26.08 17.11 15.00 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -23.89 24.28 2.03 -24.86 21.74 0.63 34.18 19.86 -14.65 35.93 20.77 -12.27 2tpl_c03 source 2tpl TYROSINE PHENOL-LYASE : 1 hits 2tpl_c03 naa= 4 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 1 3 # 1 A 46 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 100 ARG A 54 ARG.? 5.15 O2 SO4 A 201 A 116 GLN A 56 GLN^? 14.51 O2 SO4 A 201 coo 32.24 20.09 5.34 30.38 19.04 5.27 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 26.40 25.34 6.28 26.15 22.33 7.25 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 26.74 21.94 13.78 27.57 20.97 12.08 20.56 45.76 -4.92 19.77 46.12 -2.95 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 2 3 # 2 A 46 ASP A 65 ASP.? 22.23 O3 SO4 A 201 A 100 ARG A 91 ARG~? 21.95 O3 SO4 A 201 A 116 GLN A 98 GLN~? 16.84 O3 SO4 A 201 coo 32.24 20.09 5.34 30.38 19.04 5.27 7.01 55.74 -9.90 7.72 56.49 -8.05 coo 26.40 25.34 6.28 26.15 22.33 7.25 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 26.74 21.94 13.78 27.57 20.97 12.08 15.20 61.96 -8.88 13.57 60.84 -8.08 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 3 3 # 3 A 46 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 100 ARG A 54 ARG.? 5.15 O2 SO4 A 201 A 116 GLN A 56 GLN^? 14.51 O2 SO4 A 201 coo 32.24 20.09 5.34 30.38 19.04 5.27 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 26.40 25.34 6.28 26.15 22.33 7.25 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 26.74 21.94 13.78 27.57 20.97 12.08 20.56 45.76 -4.92 19.77 46.12 -2.95 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 4 3 # 4 A 46 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 100 ARG A 72 ARG^? 12.89 O3 SO4 A 201 A 116 GLN A 56 GLN^? 14.51 O2 SO4 A 201 coo 32.24 20.09 5.34 30.38 19.04 5.27 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 26.40 25.34 6.28 26.15 22.33 7.25 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 26.74 21.94 13.78 27.57 20.97 12.08 20.56 45.76 -4.92 19.77 46.12 -2.95 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 5 3 # 5 A 46 ASP A 147 ASP.? 14.36 CL CL B 203 A 100 ARG A 148 ARG.? 18.96 CL CL B 203 A 116 GLN A 37 GLN~? 21.48 CL CL B 203 coo 32.24 20.09 5.34 30.38 19.04 5.27 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 26.40 25.34 6.28 26.15 22.33 7.25 10.63 29.23 -12.53 8.60 28.94 -10.24 coo 26.74 21.94 13.78 27.57 20.97 12.08 10.48 34.34 -20.54 10.63 32.45 -21.50 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 6 3 # 6 A 46 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 100 ARG B 54 ARG.? 5.08 O4 SO4 B 202 A 116 GLN B 56 GLN^? 14.86 O4 SO4 B 202 coo 32.24 20.09 5.34 30.38 19.04 5.27 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 26.40 25.34 6.28 26.15 22.33 7.25 37.77 18.62 -0.73 37.02 15.96 0.60 coo 26.74 21.94 13.78 27.57 20.97 12.08 45.68 20.37 -2.08 46.43 20.53 -0.09 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 7 3 # 7 A 46 ASP B 65 ASP.? 21.45 O1 SO4 B 202 A 100 ARG B 91 ARG~? 22.09 O1 SO4 B 202 A 116 GLN B 98 GLN~? 16.63 O1 SO4 B 202 coo 32.24 20.09 5.34 30.38 19.04 5.27 57.62 9.59 -5.23 56.36 8.07 -4.49 coo 26.40 25.34 6.28 26.15 22.33 7.25 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 26.74 21.94 13.78 27.57 20.97 12.08 48.85 3.93 -5.97 50.52 5.01 -5.20 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 8 3 # 8 A 46 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 100 ARG B 54 ARG.? 5.08 O4 SO4 B 202 A 116 GLN B 56 GLN^? 14.86 O4 SO4 B 202 coo 32.24 20.09 5.34 30.38 19.04 5.27 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 26.40 25.34 6.28 26.15 22.33 7.25 37.77 18.62 -0.73 37.02 15.96 0.60 coo 26.74 21.94 13.78 27.57 20.97 12.08 45.68 20.37 -2.08 46.43 20.53 -0.09 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 9 3 # 9 A 46 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 100 ARG B 72 ARG^? 12.97 O1 SO4 B 202 A 116 GLN B 56 GLN^? 14.86 O4 SO4 B 202 coo 32.24 20.09 5.34 30.38 19.04 5.27 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 26.40 25.34 6.28 26.15 22.33 7.25 45.42 12.48 -0.13 47.39 14.66 0.83 coo 26.74 21.94 13.78 27.57 20.97 12.08 45.68 20.37 -2.08 46.43 20.53 -0.09 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 10 3 # 10 A 46 ASP B 136 ASP~? 35.38 CL CL B 203 A 100 ARG B 110 ARG~? 44.21 CL CL B 203 A 116 GLN B 113 GLN~? 35.97 CL CL B 203 coo 32.24 20.09 5.34 30.38 19.04 5.27 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 26.40 25.34 6.28 26.15 22.33 7.25 60.95 18.14 -32.42 62.40 18.76 -35.07 coo 26.74 21.94 13.78 27.57 20.97 12.08 53.47 13.44 -32.96 51.37 13.63 -32.59 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 11 3 # 11 A 46 ASP B 147 ASP.? 29.53 CL CL B 203 A 100 ARG B 148 ARG.? 33.47 CL CL B 203 A 116 GLN B 37 GLN~? 31.96 CL CL B 203 coo 32.24 20.09 5.34 30.38 19.04 5.27 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 26.40 25.34 6.28 26.15 22.33 7.25 58.77 36.06 -9.99 59.77 35.32 -7.22 coo 26.74 21.94 13.78 27.57 20.97 12.08 57.18 30.22 -17.87 57.50 32.05 -18.86 12as_c00 source 12as ASPARAGINE SYNTHETASE : 11 hits 12as_c00 naa= 3 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 1 3 # 1 B 46 ASP A 79 ASP^? 5.34 O4 SO4 A 201 B 100 ARG A 54 ARG.? 5.15 O2 SO4 A 201 B 116 GLN A 56 GLN^? 14.51 O2 SO4 A 201 coo 32.18 48.37 12.48 33.96 49.46 12.97 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 39.04 43.25 11.37 38.30 45.35 13.56 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 37.43 42.63 19.41 36.76 44.08 17.97 20.56 45.76 -4.92 19.77 46.12 -2.95 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 # 2 B 46 ASP A 79 ASP^? 5.34 O4 SO4 A 201 B 100 ARG A 72 ARG^? 12.89 O3 SO4 A 201 B 116 GLN A 56 GLN^? 14.51 O2 SO4 A 201 coo 32.18 48.37 12.48 33.96 49.46 12.97 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 39.04 43.25 11.37 38.30 45.35 13.56 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 37.43 42.63 19.41 36.76 44.08 17.97 20.56 45.76 -4.92 19.77 46.12 -2.95 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 3 3 # 3 B 46 ASP A 136 ASP~? 33.35 CL CL B 203 B 100 ARG A 110 ARG~? 42.02 CL CL B 203 B 116 GLN A 113 GLN~? 36.25 O4 SO4 A 201 coo 32.18 48.37 12.48 33.96 49.46 12.97 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 39.04 43.25 11.37 38.30 45.35 13.56 3.93 48.32 -34.88 2.67 46.51 -37.04 coo 37.43 42.63 19.41 36.76 44.08 17.97 12.00 51.78 -35.73 14.11 52.03 -35.38 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 4 3 # 4 B 46 ASP A 147 ASP.? 14.36 CL CL B 203 B 100 ARG A 148 ARG.? 18.96 CL CL B 203 B 116 GLN A 37 GLN~? 21.48 CL CL B 203 coo 32.18 48.37 12.48 33.96 49.46 12.97 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 39.04 43.25 11.37 38.30 45.35 13.56 10.63 29.23 -12.53 8.60 28.94 -10.24 coo 37.43 42.63 19.41 36.76 44.08 17.97 10.48 34.34 -20.54 10.63 32.45 -21.50 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 5 3 # 5 B 46 ASP B 65 ASP.? 21.45 O1 SO4 B 202 B 100 ARG B 91 ARG~? 22.09 O1 SO4 B 202 B 116 GLN B 98 GLN~? 16.63 O1 SO4 B 202 coo 32.18 48.37 12.48 33.96 49.46 12.97 57.62 9.59 -5.23 56.36 8.07 -4.49 coo 39.04 43.25 11.37 38.30 45.35 13.56 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 37.43 42.63 19.41 36.76 44.08 17.97 48.85 3.93 -5.97 50.52 5.01 -5.20 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 6 3 # 6 B 46 ASP B 79 ASP^? 5.64 O2 SO4 B 202 B 100 ARG B 54 ARG.? 5.08 O4 SO4 B 202 B 116 GLN B 56 GLN^? 14.86 O4 SO4 B 202 coo 32.18 48.37 12.48 33.96 49.46 12.97 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 39.04 43.25 11.37 38.30 45.35 13.56 37.77 18.62 -0.73 37.02 15.96 0.60 coo 37.43 42.63 19.41 36.76 44.08 17.97 45.68 20.37 -2.08 46.43 20.53 -0.09 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 7 3 # 7 B 46 ASP B 79 ASP^? 5.64 O2 SO4 B 202 B 100 ARG B 72 ARG^? 12.97 O1 SO4 B 202 B 116 GLN B 56 GLN^? 14.86 O4 SO4 B 202 coo 32.18 48.37 12.48 33.96 49.46 12.97 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 39.04 43.25 11.37 38.30 45.35 13.56 45.42 12.48 -0.13 47.39 14.66 0.83 coo 37.43 42.63 19.41 36.76 44.08 17.97 45.68 20.37 -2.08 46.43 20.53 -0.09 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 8 3 # 8 B 46 ASP B 136 ASP~? 35.38 CL CL B 203 B 100 ARG B 110 ARG~? 44.21 CL CL B 203 B 116 GLN B 113 GLN~? 35.97 CL CL B 203 coo 32.18 48.37 12.48 33.96 49.46 12.97 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 39.04 43.25 11.37 38.30 45.35 13.56 60.95 18.14 -32.42 62.40 18.76 -35.07 coo 37.43 42.63 19.41 36.76 44.08 17.97 53.47 13.44 -32.96 51.37 13.63 -32.59 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 9 3 # 9 B 46 ASP B 147 ASP.? 29.53 CL CL B 203 B 100 ARG B 148 ARG.? 33.47 CL CL B 203 B 116 GLN B 37 GLN~? 31.96 CL CL B 203 coo 32.18 48.37 12.48 33.96 49.46 12.97 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 39.04 43.25 11.37 38.30 45.35 13.56 58.77 36.06 -9.99 59.77 35.32 -7.22 coo 37.43 42.63 19.41 36.76 44.08 17.97 57.18 30.22 -17.87 57.50 32.05 -18.86 12as_c01 source 12as ASPARAGINE SYNTHETASE : 9 hits 12as_c01 naa= 3 ULMN 3 1a4s_c00 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 A 166 ASN A 128 ASN.? 15.88 O4 SO4 A 201 A 263 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 297 CYH A 96 CYH~? 19.25 O4 SO4 A 201 coo -29.12 -17.91 -4.01 -27.90 -16.18 -4.17 23.73 62.15 -16.98 21.71 62.36 -16.27 coo -22.63 -7.00 -2.71 -20.98 -7.55 -3.90 13.33 53.63 -17.82 12.09 54.13 -16.20 coo -26.23 -13.20 -9.20 -24.31 -12.88 -7.19 17.99 61.88 -15.34 18.02 61.29 -18.00 ULMN 3 1a4s_c00 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 A 166 ASN B 128 ASN.? 16.24 O2 SO4 B 202 A 263 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 297 CYH B 96 CYH~? 19.61 O1 SO4 B 202 coo -29.12 -17.91 -4.01 -27.90 -16.18 -4.17 40.54 4.79 -14.04 42.49 4.20 -13.37 coo -22.63 -7.00 -2.71 -20.98 -7.55 -3.90 51.81 11.56 -14.99 53.08 11.18 -13.32 coo -26.23 -13.20 -9.20 -24.31 -12.88 -7.19 46.07 4.30 -12.39 46.23 4.84 -15.13 1a4s_c00 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c00 naa= 3 ULMN 3 1a4s_c01 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 B 166 ASN A 128 ASN.? 15.88 O4 SO4 A 201 B 263 GLU A 83 GLU^? 22.48 O3 SO4 A 201 B 297 CYH A 96 CYH~? 19.25 O4 SO4 A 201 coo -17.71 28.81 3.98 -17.49 26.70 4.16 23.73 62.15 -16.98 21.71 62.36 -16.27 coo -16.93 16.15 2.64 -15.22 15.89 3.84 13.33 53.63 -17.82 12.09 54.13 -16.20 coo -17.36 23.25 9.07 -15.77 22.09 7.09 17.99 61.88 -15.34 18.02 61.29 -18.00 ULMN 3 1a4s_c01 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 B 166 ASN B 128 ASN.? 16.24 O2 SO4 B 202 B 263 GLU B 83 GLU^? 22.50 O1 SO4 B 202 B 297 CYH B 96 CYH~? 19.61 O1 SO4 B 202 coo -17.71 28.81 3.98 -17.49 26.70 4.16 40.54 4.79 -14.04 42.49 4.20 -13.37 coo -16.93 16.15 2.64 -15.22 15.89 3.84 51.81 11.56 -14.99 53.08 11.18 -13.32 coo -17.36 23.25 9.07 -15.77 22.09 7.09 46.07 4.30 -12.39 46.23 4.84 -15.13 1a4s_c01 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c01 naa= 3 ULMN 3 1a4s_c02 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 C 166 ASN A 128 ASN.? 15.88 O4 SO4 A 201 C 263 GLU A 83 GLU^? 22.48 O3 SO4 A 201 C 297 CYH A 96 CYH~? 19.25 O4 SO4 A 201 coo 21.46 -14.18 22.47 21.02 -12.84 20.88 23.73 62.15 -16.98 21.71 62.36 -16.27 coo 18.98 -8.30 11.46 17.52 -6.95 12.17 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 21.48 -6.84 20.62 19.38 -7.54 18.90 17.99 61.88 -15.34 18.02 61.29 -18.00 ULMN 3 1a4s_c02 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 C 166 ASN B 128 ASN.? 16.24 O2 SO4 B 202 C 263 GLU B 83 GLU^? 22.50 O1 SO4 B 202 C 297 CYH B 96 CYH~? 19.61 O1 SO4 B 202 coo 21.46 -14.18 22.47 21.02 -12.84 20.88 40.54 4.79 -14.04 42.49 4.20 -13.37 coo 18.98 -8.30 11.46 17.52 -6.95 12.17 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 21.48 -6.84 20.62 19.38 -7.54 18.90 46.07 4.30 -12.39 46.23 4.84 -15.13 1a4s_c02 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c02 naa= 3 ULMN 3 1a4s_c03 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 D 166 ASN A 128 ASN.? 15.88 O4 SO4 A 201 D 263 GLU A 83 GLU^? 22.48 O3 SO4 A 201 D 297 CYH A 96 CYH~? 19.25 O4 SO4 A 201 coo 25.54 3.42 -22.59 24.52 2.45 -20.95 23.73 62.15 -16.98 21.71 62.36 -16.27 coo 20.72 -0.76 -11.60 18.80 -1.24 -12.34 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 22.24 -3.13 -20.79 20.78 -1.47 -19.04 17.99 61.88 -15.34 18.02 61.29 -18.00 ULMN 3 1a4s_c03 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 D 166 ASN B 128 ASN.? 16.24 O2 SO4 B 202 D 263 GLU B 83 GLU^? 22.50 O1 SO4 B 202 D 297 CYH B 96 CYH~? 19.61 O1 SO4 B 202 coo 25.54 3.42 -22.59 24.52 2.45 -20.95 40.54 4.79 -14.04 42.49 4.20 -13.37 coo 20.72 -0.76 -11.60 18.80 -1.24 -12.34 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 22.24 -3.13 -20.79 20.78 -1.47 -19.04 46.07 4.30 -12.39 46.23 4.84 -15.13 1a4s_c03 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c03 naa= 3 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 1 3 # 1 142 TRP A 162 TRP^? 21.96 CL CL B 203 223 ASP A 158 ASP.? 28.53 CL CL B 203 258 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 127.19 33.46 26.14 126.78 36.79 28.15 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 126.95 41.66 23.38 128.48 40.72 24.51 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 138.83 37.95 25.17 133.50 36.37 26.52 26.03 45.00 -18.94 27.16 48.58 -22.77 1aam_c01 source 1aam ASPARTATE AMINOTRANSFERASE : 1 hits 1aam_c01 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 16 ASP^? 19.84 O2 SO4 A 201 214 ASP A 64 ASP.? 24.79 O3 SO4 A 201 289 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 26.86 59.76 46.36 25.42 58.23 45.92 5.36 51.73 -7.41 5.08 53.43 -6.17 coo 9.42 68.07 30.27 7.35 68.27 30.10 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 16 ASP^? 19.84 O2 SO4 A 201 214 ASP B 136 ASP~? 35.38 CL CL B 203 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 26.86 59.76 46.36 25.42 58.23 45.92 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 18 ASP.? 23.99 O2 SO4 A 201 214 ASP B 52 ASP.? 10.23 O4 SO4 B 202 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 26.86 59.76 46.36 25.42 58.23 45.92 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP A 18 ASP.? 23.99 O2 SO4 A 201 214 ASP B 135 ASP~? 30.33 CL CL B 203 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 26.86 59.76 46.36 25.42 58.23 45.92 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP A 18 ASP.? 23.99 O2 SO4 A 201 214 ASP B 136 ASP~? 35.38 CL CL B 203 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 26.86 59.76 46.36 25.42 58.23 45.92 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 6 3 # 6 179 ASP A 74 ASP.? -4.21 O2 SO4 A 201s 214 ASP A 88 ASP~? 29.34 O3 SO4 A 201 289 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 29.24 55.36 0.45 30.25 53.50 0.45 coo 26.86 59.76 46.36 25.42 58.23 45.92 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 9.42 68.07 30.27 7.35 68.27 30.10 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 # 7 179 ASP A 74 ASP.? -4.21 O2 SO4 A 201s 214 ASP A 158 ASP.? 28.53 CL CL B 203 289 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 29.24 55.36 0.45 30.25 53.50 0.45 coo 26.86 59.76 46.36 25.42 58.23 45.92 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 9.42 68.07 30.27 7.35 68.27 30.10 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 8 3 # 8 179 ASP A 79 ASP^? 5.34 O4 SO4 A 201 214 ASP A 166 ASP.? 11.63 CL CL B 203 289 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 26.86 59.76 46.36 25.42 58.23 45.92 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 9.42 68.07 30.27 7.35 68.27 30.10 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 # 9 179 ASP A 79 ASP^? 5.34 O4 SO4 A 201 214 ASP B 16 ASP^? 10.11 CL CL B 203 289 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 26.86 59.76 46.36 25.42 58.23 45.92 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 9.42 68.07 30.27 7.35 68.27 30.10 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 # 10 179 ASP A 147 ASP.? 14.36 CL CL B 203 214 ASP B 165 ASP.? 24.35 CL CL B 203 289 ASP A 166 ASP.? 11.63 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 26.86 59.76 46.36 25.42 58.23 45.92 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 9.42 68.07 30.27 7.35 68.27 30.10 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 11 3 # 11 179 ASP A 158 ASP.? 28.53 CL CL B 203 214 ASP B 52 ASP.? 10.23 O4 SO4 B 202 289 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 26.86 59.76 46.36 25.42 58.23 45.92 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 12 3 # 12 179 ASP A 165 ASP.? 13.91 CL CL B 203 214 ASP B 74 ASP.? -3.98 O4 SO4 B 202s 289 ASP B 18 ASP.? 13.73 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 26.86 59.76 46.36 25.42 58.23 45.92 35.83 12.25 3.35 35.06 14.20 3.07 coo 9.42 68.07 30.27 7.35 68.27 30.10 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 13 3 # 13 179 ASP A 165 ASP.? 13.91 CL CL B 203 214 ASP B 136 ASP~? 35.38 CL CL B 203 289 ASP B 16 ASP^? 10.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 26.86 59.76 46.36 25.42 58.23 45.92 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 14 3 # 14 179 ASP A 165 ASP.? 13.91 CL CL B 203 214 ASP B 136 ASP~? 35.38 CL CL B 203 289 ASP B 18 ASP.? 13.73 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 26.86 59.76 46.36 25.42 58.23 45.92 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 15 3 # 15 179 ASP A 165 ASP.? 13.91 CL CL B 203 214 ASP B 147 ASP.? 29.53 CL CL B 203 289 ASP B 16 ASP^? 10.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 26.86 59.76 46.36 25.42 58.23 45.92 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 16 3 # 16 179 ASP A 166 ASP.? 11.63 CL CL B 203 214 ASP B 136 ASP~? 35.38 CL CL B 203 289 ASP B 16 ASP^? 10.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 26.86 59.76 46.36 25.42 58.23 45.92 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 17 3 # 17 179 ASP A 166 ASP.? 11.63 CL CL B 203 214 ASP B 147 ASP.? 29.53 CL CL B 203 289 ASP B 16 ASP^? 10.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 26.86 59.76 46.36 25.42 58.23 45.92 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 18 3 # 18 179 ASP B 16 ASP^? 10.11 CL CL B 203 214 ASP A 74 ASP.? -4.21 O2 SO4 A 201s 289 ASP B 24 ASP^? 11.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 26.86 59.76 46.36 25.42 58.23 45.92 29.24 55.36 0.45 30.25 53.50 0.45 coo 9.42 68.07 30.27 7.35 68.27 30.10 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 19 3 # 19 179 ASP B 16 ASP^? 10.11 CL CL B 203 214 ASP A 79 ASP^? 5.34 O4 SO4 A 201 289 ASP B 24 ASP^? 11.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 26.86 59.76 46.36 25.42 58.23 45.92 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 9.42 68.07 30.27 7.35 68.27 30.10 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 20 3 # 20 179 ASP B 16 ASP^? 10.11 CL CL B 203 214 ASP A 135 ASP~? 30.53 CL CL B 203 289 ASP A 166 ASP.? 11.63 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 26.86 59.76 46.36 25.42 58.23 45.92 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 9.42 68.07 30.27 7.35 68.27 30.10 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 21 3 # 21 179 ASP B 16 ASP^? 10.11 CL CL B 203 214 ASP A 136 ASP~? 33.35 CL CL B 203 289 ASP A 166 ASP.? 11.63 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 26.86 59.76 46.36 25.42 58.23 45.92 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 9.42 68.07 30.27 7.35 68.27 30.10 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 22 3 # 22 179 ASP B 24 ASP^? 11.11 CL CL B 203 214 ASP B 136 ASP~? 35.38 CL CL B 203 289 ASP B 16 ASP^? 10.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 26.86 59.76 46.36 25.42 58.23 45.92 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 23 3 # 23 179 ASP B 52 ASP.? 10.23 O4 SO4 B 202 214 ASP A 18 ASP.? 23.99 O2 SO4 A 201 289 ASP B 16 ASP^? 10.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 26.86 59.76 46.36 25.42 58.23 45.92 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 24 3 # 24 179 ASP B 52 ASP.? 10.23 O4 SO4 B 202 214 ASP A 158 ASP.? 28.53 CL CL B 203 289 ASP B 16 ASP^? 10.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 26.86 59.76 46.36 25.42 58.23 45.92 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 25 3 # 25 179 ASP B 52 ASP.? 10.23 O4 SO4 B 202 214 ASP A 158 ASP.? 28.53 CL CL B 203 289 ASP B 24 ASP^? 11.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 26.86 59.76 46.36 25.42 58.23 45.92 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 9.42 68.07 30.27 7.35 68.27 30.10 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 26 3 # 26 179 ASP B 74 ASP.? -3.98 O4 SO4 B 202s 214 ASP A 165 ASP.? 13.91 CL CL B 203 289 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.83 12.25 3.35 35.06 14.20 3.07 coo 26.86 59.76 46.36 25.42 58.23 45.92 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 9.42 68.07 30.27 7.35 68.27 30.10 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 27 3 # 27 179 ASP B 74 ASP.? -3.98 O4 SO4 B 202s 214 ASP B 88 ASP~? 29.32 O1 SO4 B 202 289 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.83 12.25 3.35 35.06 14.20 3.07 coo 26.86 59.76 46.36 25.42 58.23 45.92 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 9.42 68.07 30.27 7.35 68.27 30.10 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 28 3 # 28 179 ASP B 74 ASP.? -3.98 O4 SO4 B 202s 214 ASP B 158 ASP.? 18.10 CL CL B 203 289 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.83 12.25 3.35 35.06 14.20 3.07 coo 26.86 59.76 46.36 25.42 58.23 45.92 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 9.42 68.07 30.27 7.35 68.27 30.10 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 29 3 # 29 179 ASP B 79 ASP^? 5.64 O2 SO4 B 202 214 ASP B 166 ASP.? 24.89 O2 SO4 A 201 289 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo -0.62 65.95 29.97 0.31 67.47 31.05 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 26.86 59.76 46.36 25.42 58.23 45.92 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 9.42 68.07 30.27 7.35 68.27 30.10 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 30 3 # 30 179 ASP B 147 ASP.? 29.53 CL CL B 203 214 ASP A 74 ASP.? -4.21 O2 SO4 A 201s 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 29.24 55.36 0.45 30.25 53.50 0.45 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 31 3 # 31 179 ASP B 147 ASP.? 29.53 CL CL B 203 214 ASP A 79 ASP^? 5.34 O4 SO4 A 201 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 32 3 # 32 179 ASP B 147 ASP.? 29.53 CL CL B 203 214 ASP A 165 ASP.? 13.91 CL CL B 203 289 ASP B 165 ASP.? 24.35 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 9.42 68.07 30.27 7.35 68.27 30.10 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 33 3 # 33 179 ASP B 147 ASP.? 29.53 CL CL B 203 214 ASP A 165 ASP.? 13.91 CL CL B 203 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 34 3 # 34 179 ASP B 147 ASP.? 29.53 CL CL B 203 214 ASP A 166 ASP.? 11.63 CL CL B 203 289 ASP B 165 ASP.? 24.35 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 9.42 68.07 30.27 7.35 68.27 30.10 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 35 3 # 35 179 ASP B 166 ASP.? 24.89 O2 SO4 A 201 214 ASP A 147 ASP.? 14.36 CL CL B 203 289 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 26.86 59.76 46.36 25.42 58.23 45.92 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.21 43.75 -17.91 32.76 45.38 -19.21 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 35 hits 1amy_c01 naa= 3 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 52 ASP.? 10.10 O2 SO4 A 201 204 GLU A 53 GLU.? 13.05 O2 SO4 A 201 289 ASP A 24 ASP^? 8.56 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 4.34 62.44 32.05 4.22 64.48 32.53 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 9.42 68.07 30.27 7.35 68.27 30.10 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP B 52 ASP.? 10.23 O4 SO4 B 202 204 GLU B 53 GLU.? 13.18 O4 SO4 B 202 289 ASP B 24 ASP^? 11.11 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 4.34 62.44 32.05 4.22 64.48 32.53 38.06 24.56 -1.39 36.59 24.51 0.17 coo 9.42 68.07 30.27 7.35 68.27 30.10 37.06 32.38 -6.05 35.96 33.77 -7.20 1amy_c05 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 2 hits 1amy_c05 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 18 ASP.? 23.99 O2 SO4 A 201 227 GLU A 53 GLU.? 13.05 O2 SO4 A 201 289 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 3.96 55.76 41.24 4.83 57.69 41.17 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 52 ASP.? 10.10 O2 SO4 A 201 227 GLU A 68 GLU.? 23.69 O2 SO4 A 201 289 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 3.96 55.76 41.24 4.83 57.69 41.17 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 9.42 68.07 30.27 7.35 68.27 30.10 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 52 ASP.? 10.10 O2 SO4 A 201 227 GLU A 83 GLU^? 22.48 O3 SO4 A 201 289 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 3.96 55.76 41.24 4.83 57.69 41.17 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 9.42 68.07 30.27 7.35 68.27 30.10 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP A 79 ASP^? 5.34 O4 SO4 A 201 227 GLU A 66 GLU.? 18.87 O3 SO4 A 201 289 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 3.96 55.76 41.24 4.83 57.69 41.17 10.83 52.69 -6.96 11.60 51.77 -5.23 coo 9.42 68.07 30.27 7.35 68.27 30.10 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP A 79 ASP^? 5.34 O4 SO4 A 201 227 GLU A 68 GLU.? 23.69 O2 SO4 A 201 289 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 3.96 55.76 41.24 4.83 57.69 41.17 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 9.42 68.07 30.27 7.35 68.27 30.10 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 6 3 # 6 179 ASP A 79 ASP^? 5.34 O4 SO4 A 201 227 GLU A 83 GLU^? 22.48 O3 SO4 A 201 289 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 3.96 55.76 41.24 4.83 57.69 41.17 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 9.42 68.07 30.27 7.35 68.27 30.10 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 # 7 179 ASP A 158 ASP.? 28.53 CL CL B 203 227 GLU B 171 GLU^? 23.59 CL CL B 203 289 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 3.96 55.76 41.24 4.83 57.69 41.17 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 8 3 # 8 179 ASP A 165 ASP.? 13.91 CL CL B 203 227 GLU A 171 GLU^? 26.34 CL CL B 203 289 ASP B 158 ASP.? 18.10 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 3.96 55.76 41.24 4.83 57.69 41.17 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 9.42 68.07 30.27 7.35 68.27 30.10 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 # 9 179 ASP B 16 ASP^? 10.11 CL CL B 203 227 GLU B 101 GLU^? 13.49 O2 SO4 B 202 289 ASP B 158 ASP.? 18.10 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 3.96 55.76 41.24 4.83 57.69 41.17 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 9.42 68.07 30.27 7.35 68.27 30.10 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 # 10 179 ASP B 16 ASP^? 10.11 CL CL B 203 227 GLU B 171 GLU^? 23.59 CL CL B 203 289 ASP A 165 ASP.? 13.91 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 3.96 55.76 41.24 4.83 57.69 41.17 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 9.42 68.07 30.27 7.35 68.27 30.10 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 11 3 # 11 179 ASP B 16 ASP^? 10.11 CL CL B 203 227 GLU B 171 GLU^? 23.59 CL CL B 203 289 ASP A 166 ASP.? 11.63 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 3.96 55.76 41.24 4.83 57.69 41.17 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 9.42 68.07 30.27 7.35 68.27 30.10 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 12 3 # 12 179 ASP B 18 ASP.? 13.73 CL CL B 203 227 GLU B 171 GLU^? 23.59 CL CL B 203 289 ASP A 165 ASP.? 13.91 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 3.96 55.76 41.24 4.83 57.69 41.17 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 9.42 68.07 30.27 7.35 68.27 30.10 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 13 3 # 13 179 ASP B 52 ASP.? 10.23 O4 SO4 B 202 227 GLU B 68 GLU.? 23.74 O4 SO4 B 202 289 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo -0.62 65.95 29.97 0.31 67.47 31.05 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 3.96 55.76 41.24 4.83 57.69 41.17 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 9.42 68.07 30.27 7.35 68.27 30.10 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 14 3 # 14 179 ASP B 79 ASP^? 5.64 O2 SO4 B 202 227 GLU B 66 GLU.? 19.61 O1 SO4 B 202 289 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo -0.62 65.95 29.97 0.31 67.47 31.05 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 3.96 55.76 41.24 4.83 57.69 41.17 54.16 12.70 -3.87 54.28 14.29 -2.42 coo 9.42 68.07 30.27 7.35 68.27 30.10 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 15 3 # 15 179 ASP B 79 ASP^? 5.64 O2 SO4 B 202 227 GLU B 83 GLU^? 22.50 O1 SO4 B 202 289 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo -0.62 65.95 29.97 0.31 67.47 31.05 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 3.96 55.76 41.24 4.83 57.69 41.17 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 9.42 68.07 30.27 7.35 68.27 30.10 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 16 3 # 16 179 ASP B 147 ASP.? 29.53 CL CL B 203 227 GLU B 38 GLU~? 33.41 CL CL B 203 289 ASP B 165 ASP.? 24.35 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 3.96 55.76 41.24 4.83 57.69 41.17 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 9.42 68.07 30.27 7.35 68.27 30.10 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 17 3 # 17 179 ASP B 158 ASP.? 18.10 CL CL B 203 227 GLU A 171 GLU^? 26.34 CL CL B 203 289 ASP A 166 ASP.? 11.63 CL CL B 203 coo -0.62 65.95 29.97 0.31 67.47 31.05 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 3.96 55.76 41.24 4.83 57.69 41.17 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 9.42 68.07 30.27 7.35 68.27 30.10 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 18 3 # 18 179 ASP B 166 ASP.? 24.89 O2 SO4 A 201 227 GLU A 53 GLU.? 13.05 O2 SO4 A 201 289 ASP A 18 ASP.? 23.99 O2 SO4 A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 3.96 55.76 41.24 4.83 57.69 41.17 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 9.42 68.07 30.27 7.35 68.27 30.10 35.31 47.04 -22.18 34.84 45.98 -23.97 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 18 hits 1amy_c06 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 91 ARG~? 21.95 O3 SO4 A 201 B 342 ASP A 64 ASP.? 24.79 O3 SO4 A 201 B 531 ARG A 39 ARG~? 27.60 O2 SO4 A 201 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 5.36 51.73 -7.41 5.08 53.43 -6.17 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 9.26 44.73 -19.12 9.60 47.81 -19.09 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 B 325 ARG A 91 ARG~? 21.95 O3 SO4 A 201 B 342 ASP A 64 ASP.? 24.79 O3 SO4 A 201 B 531 ARG A 90 ARG~? 30.13 O3 SO4 A 201 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 5.36 51.73 -7.41 5.08 53.43 -6.17 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 5.35 65.69 -16.45 4.68 68.72 -16.26 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 B 325 ARG B 31 ARG^? 34.85 CL CL B 203 B 342 ASP B 147 ASP.? 29.53 CL CL B 203 B 531 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 52.54 21.81 -11.81 54.35 23.52 -10.03 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 3 hits 1asy_c00 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 22 PHE^? 18.06 CL CL B 203 A 223 ASP A 24 ASP^? 8.56 CL CL B 203 A 265 LYS A 9 LYS^? 13.80 CL CL B 203 coo 39.74 52.86 65.74 41.15 55.14 66.52 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 30.70 47.50 67.53 29.83 49.47 67.39 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 19.99 54.53 64.11 20.55 58.78 68.33 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE A 22 PHE^? 18.06 CL CL B 203 A 223 ASP B 24 ASP^? 11.11 CL CL B 203 A 265 LYS B 49 LYS~? 17.28 CL CL B 203 coo 39.74 52.86 65.74 41.15 55.14 66.52 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 30.70 47.50 67.53 29.83 49.47 67.39 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 19.99 54.53 64.11 20.55 58.78 68.33 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1ax4_c04 TRYPTOPHANASE user 3 3 # 3 A 130 PHE A 22 PHE^? 18.06 CL CL B 203 A 223 ASP B 165 ASP.? 24.35 CL CL B 203 A 265 LYS B 141 LYS~? 32.09 CL CL B 203 coo 39.74 52.86 65.74 41.15 55.14 66.52 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 30.70 47.50 67.53 29.83 49.47 67.39 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 19.99 54.53 64.11 20.55 58.78 68.33 50.65 30.91 -26.07 50.03 31.36 -31.64 ULMN 3 1ax4_c04 TRYPTOPHANASE user 4 3 # 4 A 130 PHE B 22 PHE^? 5.22 CL CL B 203 A 223 ASP B 24 ASP^? 11.11 CL CL B 203 A 265 LYS B 9 LYS^? 26.01 CL CL B 203 coo 39.74 52.86 65.74 41.15 55.14 66.52 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 30.70 47.50 67.53 29.83 49.47 67.39 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 19.99 54.53 64.11 20.55 58.78 68.33 50.82 33.22 -7.07 51.79 32.01 -1.71 1ax4_c04 source 1ax4 TRYPTOPHANASE : 4 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 22 PHE^? 18.06 CL CL B 203 B 223 ASP A 24 ASP^? 8.56 CL CL B 203 B 265 LYS A 9 LYS^? 13.80 CL CL B 203 coo 7.48 54.94 99.62 7.67 52.27 100.42 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 10.43 61.66 91.81 9.80 60.04 90.61 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 5.43 58.06 80.08 8.57 53.00 79.37 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE A 22 PHE^? 18.06 CL CL B 203 B 223 ASP B 24 ASP^? 11.11 CL CL B 203 B 265 LYS B 49 LYS~? 17.28 CL CL B 203 coo 7.48 54.94 99.62 7.67 52.27 100.42 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 10.43 61.66 91.81 9.80 60.04 90.61 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 5.43 58.06 80.08 8.57 53.00 79.37 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1ax4_c05 TRYPTOPHANASE user 3 3 # 3 B 130 PHE A 22 PHE^? 18.06 CL CL B 203 B 223 ASP B 165 ASP.? 24.35 CL CL B 203 B 265 LYS B 141 LYS~? 32.09 CL CL B 203 coo 7.48 54.94 99.62 7.67 52.27 100.42 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 10.43 61.66 91.81 9.80 60.04 90.61 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 5.43 58.06 80.08 8.57 53.00 79.37 50.65 30.91 -26.07 50.03 31.36 -31.64 ULMN 3 1ax4_c05 TRYPTOPHANASE user 4 3 # 4 B 130 PHE B 22 PHE^? 5.22 CL CL B 203 B 223 ASP B 24 ASP^? 11.11 CL CL B 203 B 265 LYS B 9 LYS^? 26.01 CL CL B 203 coo 7.48 54.94 99.62 7.67 52.27 100.42 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 10.43 61.66 91.81 9.80 60.04 90.61 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 5.43 58.06 80.08 8.57 53.00 79.37 50.82 33.22 -7.07 51.79 32.01 -1.71 1ax4_c05 source 1ax4 TRYPTOPHANASE : 4 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 22 PHE^? 18.06 CL CL B 203 C 223 ASP A 24 ASP^? 8.56 CL CL B 203 C 265 LYS A 9 LYS^? 13.80 CL CL B 203 coo -6.55 73.45 23.60 -6.77 71.48 21.66 37.35 40.04 -13.97 38.92 40.57 -16.22 coo -9.52 75.74 33.62 -8.85 73.74 33.93 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -4.44 67.20 42.32 -7.50 62.41 40.49 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE A 22 PHE^? 18.06 CL CL B 203 C 223 ASP B 24 ASP^? 11.11 CL CL B 203 C 265 LYS B 49 LYS~? 17.28 CL CL B 203 coo -6.55 73.45 23.60 -6.77 71.48 21.66 37.35 40.04 -13.97 38.92 40.57 -16.22 coo -9.52 75.74 33.62 -8.85 73.74 33.93 37.06 32.38 -6.05 35.96 33.77 -7.20 coo -4.44 67.20 42.32 -7.50 62.41 40.49 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1ax4_c06 TRYPTOPHANASE user 3 3 # 3 C 130 PHE A 22 PHE^? 18.06 CL CL B 203 C 223 ASP B 165 ASP.? 24.35 CL CL B 203 C 265 LYS B 141 LYS~? 32.09 CL CL B 203 coo -6.55 73.45 23.60 -6.77 71.48 21.66 37.35 40.04 -13.97 38.92 40.57 -16.22 coo -9.52 75.74 33.62 -8.85 73.74 33.93 45.25 37.97 -17.38 46.58 38.45 -18.99 coo -4.44 67.20 42.32 -7.50 62.41 40.49 50.65 30.91 -26.07 50.03 31.36 -31.64 ULMN 3 1ax4_c06 TRYPTOPHANASE user 4 3 # 4 C 130 PHE B 22 PHE^? 5.22 CL CL B 203 C 223 ASP B 24 ASP^? 11.11 CL CL B 203 C 265 LYS B 9 LYS^? 26.01 CL CL B 203 coo -6.55 73.45 23.60 -6.77 71.48 21.66 30.20 29.70 -11.84 28.90 29.99 -14.32 coo -9.52 75.74 33.62 -8.85 73.74 33.93 37.06 32.38 -6.05 35.96 33.77 -7.20 coo -4.44 67.20 42.32 -7.50 62.41 40.49 50.82 33.22 -7.07 51.79 32.01 -1.71 1ax4_c06 source 1ax4 TRYPTOPHANASE : 4 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 22 PHE^? 18.06 CL CL B 203 D 223 ASP A 24 ASP^? 8.56 CL CL B 203 D 265 LYS A 9 LYS^? 13.80 CL CL B 203 coo -38.60 55.38 52.70 -40.06 57.72 53.04 37.35 40.04 -13.97 38.92 40.57 -16.22 coo -29.46 51.67 48.51 -28.63 53.31 49.56 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -18.87 56.53 54.79 -19.47 62.22 53.03 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE A 22 PHE^? 18.06 CL CL B 203 D 223 ASP B 24 ASP^? 11.11 CL CL B 203 D 265 LYS B 49 LYS~? 17.28 CL CL B 203 coo -38.60 55.38 52.70 -40.06 57.72 53.04 37.35 40.04 -13.97 38.92 40.57 -16.22 coo -29.46 51.67 48.51 -28.63 53.31 49.56 37.06 32.38 -6.05 35.96 33.77 -7.20 coo -18.87 56.53 54.79 -19.47 62.22 53.03 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1ax4_c07 TRYPTOPHANASE user 3 3 # 3 D 130 PHE A 22 PHE^? 18.06 CL CL B 203 D 223 ASP B 165 ASP.? 24.35 CL CL B 203 D 265 LYS B 141 LYS~? 32.09 CL CL B 203 coo -38.60 55.38 52.70 -40.06 57.72 53.04 37.35 40.04 -13.97 38.92 40.57 -16.22 coo -29.46 51.67 48.51 -28.63 53.31 49.56 45.25 37.97 -17.38 46.58 38.45 -18.99 coo -18.87 56.53 54.79 -19.47 62.22 53.03 50.65 30.91 -26.07 50.03 31.36 -31.64 ULMN 3 1ax4_c07 TRYPTOPHANASE user 4 3 # 4 D 130 PHE B 22 PHE^? 5.22 CL CL B 203 D 223 ASP B 24 ASP^? 11.11 CL CL B 203 D 265 LYS B 9 LYS^? 26.01 CL CL B 203 coo -38.60 55.38 52.70 -40.06 57.72 53.04 30.20 29.70 -11.84 28.90 29.99 -14.32 coo -29.46 51.67 48.51 -28.63 53.31 49.56 37.06 32.38 -6.05 35.96 33.77 -7.20 coo -18.87 56.53 54.79 -19.47 62.22 53.03 50.82 33.22 -7.07 51.79 32.01 -1.71 1ax4_c07 source 1ax4 TRYPTOPHANASE : 4 hits 1ax4_c07 naa= 3 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 A 140 TRP A 162 TRP^? 21.96 CL CL B 203 A 222 ASP A 158 ASP.? 28.53 CL CL B 203 A 258 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 89.83 15.40 0.01 90.61 18.86 1.71 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 82.92 20.43 2.47 84.82 20.45 1.55 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 26.03 45.00 -18.94 27.16 48.58 -22.77 1ay4_c02 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 1 hits 1ay4_c02 naa= 3 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 B 140 TRP A 162 TRP^? 21.96 CL CL B 203 B 222 ASP A 158 ASP.? 28.53 CL CL B 203 B 258 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 103.45 44.39 16.20 102.66 41.02 14.32 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 110.10 38.66 15.58 108.40 39.41 14.53 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 107.51 45.54 4.76 105.41 44.51 10.25 26.03 45.00 -18.94 27.16 48.58 -22.77 1ay4_c03 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 1 hits 1ay4_c03 naa= 3 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 A 109 ASP A 24 ASP^? 8.56 CL CL B 203 A 182 GLU A 53 GLU.? 13.05 O2 SO4 A 201 A 286 ASN A 13 ASN^? 10.47 CL CL B 203 coo 26.03 44.66 108.90 25.67 42.61 108.82 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 18.06 44.02 105.38 18.08 45.37 107.03 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 25.47 38.28 112.06 27.26 39.30 111.54 30.72 33.91 -14.09 32.77 34.57 -14.11 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 # 2 A 109 ASP A 88 ASP~? 29.34 O3 SO4 A 201 A 182 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 286 ASN A 119 ASN~? 31.45 O4 SO4 A 201 coo 26.03 44.66 108.90 25.67 42.61 108.82 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 18.06 44.02 105.38 18.08 45.37 107.03 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 25.47 38.28 112.06 27.26 39.30 111.54 11.73 60.90 -27.86 9.72 60.89 -27.11 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 3 3 # 3 A 109 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 182 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 286 ASN B 119 ASN~? 31.61 O1 SO4 B 202 coo 26.03 44.66 108.90 25.67 42.61 108.82 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 18.06 44.02 105.38 18.08 45.37 107.03 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 25.47 38.28 112.06 27.26 39.30 111.54 52.38 4.31 -25.10 54.19 3.61 -24.21 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 4 3 # 4 A 109 ASP B 158 ASP.? 18.10 CL CL B 203 A 182 GLU B 171 GLU^? 23.59 CL CL B 203 A 286 ASN A 169 ASN^? 18.01 CL CL B 203 coo 26.03 44.66 108.90 25.67 42.61 108.82 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 18.06 44.02 105.38 18.08 45.37 107.03 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 25.47 38.28 112.06 27.26 39.30 111.54 27.78 29.97 -27.47 29.46 31.04 -26.71 1b57_c00 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 4 hits 1b57_c00 naa= 3 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 B 109 ASP A 24 ASP^? 8.56 CL CL B 203 B 182 GLU A 53 GLU.? 13.05 O2 SO4 A 201 B 286 ASN A 13 ASN^? 10.47 CL CL B 203 coo 13.82 69.26 132.27 11.87 70.14 132.51 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 8.74 63.05 136.42 9.87 62.19 134.79 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 8.26 72.60 129.22 10.14 73.45 129.80 30.72 33.91 -14.09 32.77 34.57 -14.11 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 # 2 B 109 ASP A 24 ASP^? 8.56 CL CL B 203 B 182 GLU A 53 GLU.? 13.05 O2 SO4 A 201 B 286 ASN B 13 ASN^? 10.38 CL CL B 203 coo 13.82 69.26 132.27 11.87 70.14 132.51 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 8.74 63.05 136.42 9.87 62.19 134.79 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 8.26 72.60 129.22 10.14 73.45 129.80 37.49 33.73 -11.31 35.37 33.37 -11.20 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 3 3 # 3 B 109 ASP A 88 ASP~? 29.34 O3 SO4 A 201 B 182 GLU A 83 GLU^? 22.48 O3 SO4 A 201 B 286 ASN A 119 ASN~? 31.45 O4 SO4 A 201 coo 13.82 69.26 132.27 11.87 70.14 132.51 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 8.74 63.05 136.42 9.87 62.19 134.79 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 8.26 72.60 129.22 10.14 73.45 129.80 11.73 60.90 -27.86 9.72 60.89 -27.11 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 4 3 # 4 B 109 ASP B 24 ASP^? 11.11 CL CL B 203 B 182 GLU B 53 GLU.? 13.18 O4 SO4 B 202 B 286 ASN B 13 ASN^? 10.38 CL CL B 203 coo 13.82 69.26 132.27 11.87 70.14 132.51 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 8.74 63.05 136.42 9.87 62.19 134.79 38.06 24.56 -1.39 36.59 24.51 0.17 coo 8.26 72.60 129.22 10.14 73.45 129.80 37.49 33.73 -11.31 35.37 33.37 -11.20 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 5 3 # 5 B 109 ASP B 88 ASP~? 29.32 O1 SO4 B 202 B 182 GLU B 83 GLU^? 22.50 O1 SO4 B 202 B 286 ASN B 119 ASN~? 31.61 O1 SO4 B 202 coo 13.82 69.26 132.27 11.87 70.14 132.51 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 8.74 63.05 136.42 9.87 62.19 134.79 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 8.26 72.60 129.22 10.14 73.45 129.80 52.38 4.31 -25.10 54.19 3.61 -24.21 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 6 3 # 6 B 109 ASP B 158 ASP.? 18.10 CL CL B 203 B 182 GLU B 171 GLU^? 23.59 CL CL B 203 B 286 ASN A 169 ASN^? 18.01 CL CL B 203 coo 13.82 69.26 132.27 11.87 70.14 132.51 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 8.74 63.05 136.42 9.87 62.19 134.79 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 8.26 72.60 129.22 10.14 73.45 129.80 27.78 29.97 -27.47 29.46 31.04 -26.71 1b57_c01 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 6 hits 1b57_c01 naa= 3 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 A 145 TYR A 107 TYR.? 29.41 CL CL B 203 A 230 ASP A 135 ASP~? 30.53 CL CL B 203 A 273 LYS A 141 LYS~? 27.34 CL CL B 203 coo 9.23 21.44 106.88 10.18 19.34 105.31 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 1.45 22.80 104.16 2.58 21.02 104.01 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 2.97 11.64 107.87 6.59 15.13 107.03 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 A 145 TYR B 107 TYR.? 30.85 O4 SO4 B 202 A 230 ASP B 135 ASP~? 30.33 CL CL B 203 A 273 LYS B 141 LYS~? 32.09 CL CL B 203 coo 9.23 21.44 106.88 10.18 19.34 105.31 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 1.45 22.80 104.16 2.58 21.02 104.01 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 2.97 11.64 107.87 6.59 15.13 107.03 50.65 30.91 -26.07 50.03 31.36 -31.64 1b8g_c04 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 2 hits 1b8g_c04 naa= 3 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 B 145 TYR A 107 TYR.? 29.41 CL CL B 203 B 230 ASP A 135 ASP~? 30.53 CL CL B 203 B 273 LYS A 141 LYS~? 27.34 CL CL B 203 coo 11.81 13.41 73.03 10.00 13.03 75.12 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 19.17 11.01 76.14 17.26 10.42 76.77 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 11.10 2.31 76.60 10.24 7.24 75.62 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 B 145 TYR B 107 TYR.? 30.85 O4 SO4 B 202 B 230 ASP B 135 ASP~? 30.33 CL CL B 203 B 273 LYS B 141 LYS~? 32.09 CL CL B 203 coo 11.81 13.41 73.03 10.00 13.03 75.12 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 19.17 11.01 76.14 17.26 10.42 76.77 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 11.10 2.31 76.60 10.24 7.24 75.62 50.65 30.91 -26.07 50.03 31.36 -31.64 1b8g_c05 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 2 hits 1b8g_c05 naa= 3 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 1 3 # 1 A 88 PHE A 22 PHE^? 18.06 CL CL B 203 A 159 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 188 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 13.91 34.58 14.67 12.95 36.00 12.47 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 20.97 28.40 16.26 20.19 30.15 15.34 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 22.55 41.65 15.60 18.92 37.20 14.63 46.06 42.14 -21.13 50.44 45.35 -19.26 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 1 hits 1b9h_c02 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 141 THR A 36 THR~? 28.00 CL CL B 203 A 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo 6.21 93.81 36.58 4.58 96.33 37.17 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 6.80 92.87 28.33 4.91 92.74 27.40 6.76 39.13 -20.62 6.63 40.45 -22.30 coo 12.98 90.36 47.57 11.26 89.62 46.62 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 141 THR A 106 THR^? 28.37 O4 SO4 A 201 A 235 ASP A 64 ASP.? 24.79 O3 SO4 A 201 coo 6.21 93.81 36.58 4.58 96.33 37.17 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 6.80 92.87 28.33 4.91 92.74 27.40 14.50 50.35 -25.62 15.23 52.07 -26.73 coo 12.98 90.36 47.57 11.26 89.62 46.62 5.36 51.73 -7.41 5.08 53.43 -6.17 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 A 137 ARG A 43 ARG~? 21.16 CL CL B 203 A 141 THR A 28 THR^? 14.97 CL CL B 203 A 235 ASP A 64 ASP.? 24.79 O3 SO4 A 201 coo 6.21 93.81 36.58 4.58 96.33 37.17 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 6.80 92.87 28.33 4.91 92.74 27.40 16.85 36.90 -7.98 16.09 36.18 -6.07 coo 12.98 90.36 47.57 11.26 89.62 46.62 5.36 51.73 -7.41 5.08 53.43 -6.17 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 A 137 ARG A 43 ARG~? 21.16 CL CL B 203 A 141 THR A 28 THR^? 14.97 CL CL B 203 A 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo 6.21 93.81 36.58 4.58 96.33 37.17 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 6.80 92.87 28.33 4.91 92.74 27.40 16.85 36.90 -7.98 16.09 36.18 -6.07 coo 12.98 90.36 47.57 11.26 89.62 46.62 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 A 137 ARG A 43 ARG~? 21.16 CL CL B 203 A 141 THR A 36 THR~? 28.00 CL CL B 203 A 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo 6.21 93.81 36.58 4.58 96.33 37.17 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 6.80 92.87 28.33 4.91 92.74 27.40 6.76 39.13 -20.62 6.63 40.45 -22.30 coo 12.98 90.36 47.57 11.26 89.62 46.62 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 A 137 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 141 THR B 106 THR^? 28.62 O2 SO4 B 202 A 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo 6.21 93.81 36.58 4.58 96.33 37.17 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 6.80 92.87 28.33 4.91 92.74 27.40 51.12 15.13 -22.70 50.21 13.51 -23.79 coo 12.98 90.36 47.57 11.26 89.62 46.62 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 A 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 141 THR B 28 THR^? 24.75 O4 SO4 B 202 A 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo 6.21 93.81 36.58 4.58 96.33 37.17 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 6.80 92.87 28.33 4.91 92.74 27.40 50.62 28.88 -5.28 51.38 29.38 -3.32 coo 12.98 90.36 47.57 11.26 89.62 46.62 57.62 9.59 -5.23 56.36 8.07 -4.49 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 7 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG A 39 ARG~? 27.60 O2 SO4 A 201 D 141 THR A 106 THR^? 28.37 O4 SO4 A 201 D 235 ASP A 64 ASP.? 24.79 O3 SO4 A 201 coo -8.33 92.80 100.06 -7.71 95.33 98.44 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -9.24 93.49 108.77 -7.37 94.21 109.61 14.50 50.35 -25.62 15.23 52.07 -26.73 coo -14.64 87.74 89.51 -12.89 87.43 90.65 5.36 51.73 -7.41 5.08 53.43 -6.17 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 D 137 ARG A 43 ARG~? 21.16 CL CL B 203 D 141 THR A 28 THR^? 14.97 CL CL B 203 D 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo -8.33 92.80 100.06 -7.71 95.33 98.44 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -9.24 93.49 108.77 -7.37 94.21 109.61 16.85 36.90 -7.98 16.09 36.18 -6.07 coo -14.64 87.74 89.51 -12.89 87.43 90.65 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 D 137 ARG A 43 ARG~? 21.16 CL CL B 203 D 141 THR A 36 THR~? 28.00 CL CL B 203 D 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo -8.33 92.80 100.06 -7.71 95.33 98.44 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -9.24 93.49 108.77 -7.37 94.21 109.61 6.76 39.13 -20.62 6.63 40.45 -22.30 coo -14.64 87.74 89.51 -12.89 87.43 90.65 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 D 137 ARG B 39 ARG~? 27.56 O4 SO4 B 202 D 141 THR B 106 THR^? 28.62 O2 SO4 B 202 D 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -8.33 92.80 100.06 -7.71 95.33 98.44 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -9.24 93.49 108.77 -7.37 94.21 109.61 51.12 15.13 -22.70 50.21 13.51 -23.79 coo -14.64 87.74 89.51 -12.89 87.43 90.65 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 D 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 D 141 THR B 28 THR^? 24.75 O4 SO4 B 202 D 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -8.33 92.80 100.06 -7.71 95.33 98.44 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -9.24 93.49 108.77 -7.37 94.21 109.61 50.62 28.88 -5.28 51.38 29.38 -3.32 coo -14.64 87.74 89.51 -12.89 87.43 90.65 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 D 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 D 141 THR B 36 THR~? 34.43 O4 SO4 B 202 D 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -8.33 92.80 100.06 -7.71 95.33 98.44 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -9.24 93.49 108.77 -7.37 94.21 109.61 60.36 24.94 -17.76 60.17 23.61 -19.48 coo -14.64 87.74 89.51 -12.89 87.43 90.65 57.62 9.59 -5.23 56.36 8.07 -4.49 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 6 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 39 ARG~? 27.60 O2 SO4 A 201 C 141 THR A 106 THR^? 28.37 O4 SO4 A 201 C 235 ASP A 64 ASP.? 24.79 O3 SO4 A 201 coo -5.79 67.26 36.83 -4.57 64.58 37.74 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -6.81 68.31 28.28 -4.82 68.47 27.57 14.50 50.35 -25.62 15.23 52.07 -26.73 coo -13.01 70.96 47.58 -11.44 71.65 46.34 5.36 51.73 -7.41 5.08 53.43 -6.17 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG A 43 ARG~? 21.16 CL CL B 203 C 141 THR A 28 THR^? 14.97 CL CL B 203 C 235 ASP A 64 ASP.? 24.79 O3 SO4 A 201 coo -5.79 67.26 36.83 -4.57 64.58 37.74 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -6.81 68.31 28.28 -4.82 68.47 27.57 16.85 36.90 -7.98 16.09 36.18 -6.07 coo -13.01 70.96 47.58 -11.44 71.65 46.34 5.36 51.73 -7.41 5.08 53.43 -6.17 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 C 137 ARG A 43 ARG~? 21.16 CL CL B 203 C 141 THR A 28 THR^? 14.97 CL CL B 203 C 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo -5.79 67.26 36.83 -4.57 64.58 37.74 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -6.81 68.31 28.28 -4.82 68.47 27.57 16.85 36.90 -7.98 16.09 36.18 -6.07 coo -13.01 70.96 47.58 -11.44 71.65 46.34 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 C 137 ARG A 43 ARG~? 21.16 CL CL B 203 C 141 THR A 36 THR~? 28.00 CL CL B 203 C 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo -5.79 67.26 36.83 -4.57 64.58 37.74 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -6.81 68.31 28.28 -4.82 68.47 27.57 6.76 39.13 -20.62 6.63 40.45 -22.30 coo -13.01 70.96 47.58 -11.44 71.65 46.34 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 C 137 ARG B 39 ARG~? 27.56 O4 SO4 B 202 C 141 THR B 106 THR^? 28.62 O2 SO4 B 202 C 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -5.79 67.26 36.83 -4.57 64.58 37.74 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -6.81 68.31 28.28 -4.82 68.47 27.57 51.12 15.13 -22.70 50.21 13.51 -23.79 coo -13.01 70.96 47.58 -11.44 71.65 46.34 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 C 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 C 141 THR B 28 THR^? 24.75 O4 SO4 B 202 C 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -5.79 67.26 36.83 -4.57 64.58 37.74 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -6.81 68.31 28.28 -4.82 68.47 27.57 50.62 28.88 -5.28 51.38 29.38 -3.32 coo -13.01 70.96 47.58 -11.44 71.65 46.34 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 C 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 C 141 THR B 36 THR~? 34.43 O4 SO4 B 202 C 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo -5.79 67.26 36.83 -4.57 64.58 37.74 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -6.81 68.31 28.28 -4.82 68.47 27.57 60.36 24.94 -17.76 60.17 23.61 -19.48 coo -13.01 70.96 47.58 -11.44 71.65 46.34 57.62 9.59 -5.23 56.36 8.07 -4.49 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 7 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 39 ARG~? 27.60 O2 SO4 A 201 B 141 THR A 106 THR^? 28.37 O4 SO4 A 201 B 235 ASP A 64 ASP.? 24.79 O3 SO4 A 201 coo 8.13 67.41 100.27 7.18 68.35 97.45 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 8.28 67.78 108.81 6.22 67.65 109.43 14.50 50.35 -25.62 15.23 52.07 -26.73 coo 14.55 73.52 89.47 12.81 73.95 90.56 5.36 51.73 -7.41 5.08 53.43 -6.17 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG A 43 ARG~? 21.16 CL CL B 203 B 141 THR A 28 THR^? 14.97 CL CL B 203 B 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo 8.13 67.41 100.27 7.18 68.35 97.45 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 8.28 67.78 108.81 6.22 67.65 109.43 16.85 36.90 -7.98 16.09 36.18 -6.07 coo 14.55 73.52 89.47 12.81 73.95 90.56 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 B 137 ARG A 43 ARG~? 21.16 CL CL B 203 B 141 THR A 36 THR~? 28.00 CL CL B 203 B 235 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo 8.13 67.41 100.27 7.18 68.35 97.45 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 8.28 67.78 108.81 6.22 67.65 109.43 6.76 39.13 -20.62 6.63 40.45 -22.30 coo 14.55 73.52 89.47 12.81 73.95 90.56 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 B 137 ARG A 43 ARG~? 21.16 CL CL B 203 B 141 THR A 58 THR.? 18.50 O2 SO4 A 201 B 235 ASP A 147 ASP.? 14.36 CL CL B 203 coo 8.13 67.41 100.27 7.18 68.35 97.45 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 8.28 67.78 108.81 6.22 67.65 109.43 13.54 46.83 -7.49 13.73 48.88 -6.92 coo 14.55 73.52 89.47 12.81 73.95 90.56 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 B 137 ARG B 39 ARG~? 27.56 O4 SO4 B 202 B 141 THR B 106 THR^? 28.62 O2 SO4 B 202 B 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo 8.13 67.41 100.27 7.18 68.35 97.45 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 8.28 67.78 108.81 6.22 67.65 109.43 51.12 15.13 -22.70 50.21 13.51 -23.79 coo 14.55 73.52 89.47 12.81 73.95 90.56 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 B 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 B 141 THR B 28 THR^? 24.75 O4 SO4 B 202 B 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo 8.13 67.41 100.27 7.18 68.35 97.45 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 8.28 67.78 108.81 6.22 67.65 109.43 50.62 28.88 -5.28 51.38 29.38 -3.32 coo 14.55 73.52 89.47 12.81 73.95 90.56 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 B 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 B 141 THR B 36 THR~? 34.43 O4 SO4 B 202 B 235 ASP B 65 ASP.? 21.45 O1 SO4 B 202 coo 8.13 67.41 100.27 7.18 68.35 97.45 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 8.28 67.78 108.81 6.22 67.65 109.43 60.36 24.94 -17.76 60.17 23.61 -19.48 coo 14.55 73.52 89.47 12.81 73.95 90.56 57.62 9.59 -5.23 56.36 8.07 -4.49 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 8 3 # 8 B 137 ARG B 43 ARG~? 25.25 O4 SO4 B 202 B 141 THR B 58 THR.? 18.67 O4 SO4 B 202 B 235 ASP B 147 ASP.? 29.53 CL CL B 203 coo 8.13 67.41 100.27 7.18 68.35 97.45 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 8.28 67.78 108.81 6.22 67.65 109.43 52.55 18.59 -4.72 52.09 16.59 -4.08 coo 14.55 73.52 89.47 12.81 73.95 90.56 52.99 37.46 -14.27 53.96 39.20 -13.53 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 8 hits 1bd3_c03 naa= 3 ULMN 3 1bf2_c00 ISOAMYLASE user 1 3 # 1 375 ASP A 52 ASP.? 10.10 O2 SO4 A 201 435 GLU A 53 GLU.? 13.05 O2 SO4 A 201 510 ASP A 24 ASP^? 8.56 CL CL B 203 coo 88.62 69.90 41.16 89.05 70.67 43.04 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 89.52 76.11 40.17 89.01 75.16 41.97 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 84.89 77.60 46.67 85.63 75.79 46.03 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1bf2_c00 ISOAMYLASE user 2 3 # 2 375 ASP B 52 ASP.? 10.23 O4 SO4 B 202 435 GLU B 53 GLU.? 13.18 O4 SO4 B 202 510 ASP B 24 ASP^? 11.11 CL CL B 203 coo 88.62 69.90 41.16 89.05 70.67 43.04 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 89.52 76.11 40.17 89.01 75.16 41.97 38.06 24.56 -1.39 36.59 24.51 0.17 coo 84.89 77.60 46.67 85.63 75.79 46.03 37.06 32.38 -6.05 35.96 33.77 -7.20 1bf2_c00 source 1bf2 ISOAMYLASE : 2 hits 1bf2_c00 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 35 GLU.? 23.66 CL CL B 203 A 503 TYR A 107 TYR.? 29.41 CL CL B 203 A 537 GLU A 38 GLU~? 28.10 CL CL B 203 coo 24.06 146.21 11.09 22.89 146.18 9.36 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 15.91 140.69 8.32 15.71 143.39 9.13 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 16.65 144.44 13.24 18.34 145.22 12.33 10.35 38.63 -25.29 9.73 39.61 -27.07 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 2 3 # 2 A 461 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 503 TYR B 107 TYR.? 30.85 O4 SO4 B 202 A 537 GLU B 38 GLU~? 33.41 CL CL B 203 coo 24.06 146.21 11.09 22.89 146.18 9.36 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 15.91 140.69 8.32 15.71 143.39 9.13 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 16.65 144.44 13.24 18.34 145.22 12.33 56.16 26.15 -22.68 57.22 25.29 -24.33 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 2 hits 1bgl_c08 naa= 3 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 # 1 A 451 GLU A 35 GLU.? 23.66 CL CL B 203 A 504 TYR A 107 TYR.? 29.41 CL CL B 203 A 540 GLU A 38 GLU~? 28.10 CL CL B 203 coo 81.34 87.29 87.22 82.36 86.09 88.61 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 80.85 81.34 94.77 81.70 80.16 92.41 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 79.94 80.46 88.84 81.11 81.36 87.27 10.35 38.63 -25.29 9.73 39.61 -27.07 1bhg_c02 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c02 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 451 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 540 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 79.04 80.20 80.81 79.58 81.40 83.63 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 81.34 87.29 87.22 82.36 86.09 88.61 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 79.94 80.46 88.84 81.11 81.36 87.27 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 451 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 540 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 79.04 80.20 80.81 79.58 81.40 83.63 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 81.34 87.29 87.22 82.36 86.09 88.61 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 79.94 80.46 88.84 81.11 81.36 87.27 52.13 16.66 -12.75 54.11 15.89 -12.66 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 39 ARG~? 27.60 O2 SO4 A 201 B 451 GLU A 83 GLU^? 22.48 O3 SO4 A 201 B 540 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 82.21 41.07 119.14 83.95 40.66 116.59 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 86.52 35.28 112.74 87.08 36.38 110.99 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 83.38 41.19 112.55 85.47 40.59 112.72 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 # 2 B 382 ARG A 91 ARG~? 21.95 O3 SO4 A 201 B 451 GLU A 68 GLU.? 23.69 O2 SO4 A 201 B 540 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo 82.21 41.07 119.14 83.95 40.66 116.59 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 86.52 35.28 112.74 87.08 36.38 110.99 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 83.38 41.19 112.55 85.47 40.59 112.72 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 3 3 # 3 B 382 ARG B 39 ARG~? 27.56 O4 SO4 B 202 B 451 GLU B 83 GLU^? 22.50 O1 SO4 B 202 B 540 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 82.21 41.07 119.14 83.95 40.66 116.59 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 86.52 35.28 112.74 87.08 36.38 110.99 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 83.38 41.19 112.55 85.47 40.59 112.72 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 4 3 # 4 B 382 ARG B 43 ARG~? 25.25 O4 SO4 B 202 B 451 GLU B 83 GLU^? 22.50 O1 SO4 B 202 B 540 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 82.21 41.07 119.14 83.95 40.66 116.59 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 86.52 35.28 112.74 87.08 36.38 110.99 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 83.38 41.19 112.55 85.47 40.59 112.72 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 5 3 # 5 B 382 ARG B 91 ARG~? 22.09 O1 SO4 B 202 B 451 GLU B 68 GLU.? 23.74 O4 SO4 B 202 B 540 GLU B 83 GLU^? 22.50 O1 SO4 B 202 coo 82.21 41.07 119.14 83.95 40.66 116.59 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 86.52 35.28 112.74 87.08 36.38 110.99 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 83.38 41.19 112.55 85.47 40.59 112.72 51.81 11.56 -14.99 53.08 11.18 -13.32 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 5 hits 1bhg_c05 naa= 3 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 1 3 # 1 A 102 TRP A 115 TRP~? 30.09 O4 SO4 A 201 A 174 ASP A 88 ASP~? 29.34 O3 SO4 A 201 A 198 LYS A 122 LYS~? 33.55 O4 SO4 A 201 coo 21.59 67.76 35.19 19.10 64.95 36.34 9.03 56.91 -26.77 12.93 56.71 -26.19 coo 19.39 73.14 39.98 19.70 71.07 40.14 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 27.94 65.10 43.55 24.20 64.94 40.01 14.46 65.90 -26.67 9.45 67.99 -27.93 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 2 3 # 2 A 102 TRP A 162 TRP^? 21.96 CL CL B 203 A 174 ASP A 158 ASP.? 28.53 CL CL B 203 A 198 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 21.59 67.76 35.19 19.10 64.95 36.34 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 19.39 73.14 39.98 19.70 71.07 40.14 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 27.94 65.10 43.55 24.20 64.94 40.01 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 3 3 # 3 A 102 TRP B 115 TRP~? 30.44 O1 SO4 B 202 A 174 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 198 LYS B 122 LYS~? 34.58 O2 SO4 B 202 coo 21.59 67.76 35.19 19.10 64.95 36.34 55.54 8.04 -24.08 51.69 8.57 -23.51 coo 19.39 73.14 39.98 19.70 71.07 40.14 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 27.94 65.10 43.55 24.20 64.94 40.01 48.89 -0.01 -23.68 54.40 -1.08 -26.39 1bjo_c00 source 1bjo PHOSPHOSERINE AMINOTRANSFERASE : 3 hits 1bjo_c00 naa= 3 ULMN 3 1bqc_c01 BETA-MANNANASE user 1 3 # 1 A 50 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 128 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 225 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 38.56 19.11 14.83 37.12 21.00 16.76 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 36.48 24.43 22.02 36.86 26.34 21.13 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 40.16 23.71 17.01 38.52 24.96 17.40 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1bqc_c01 BETA-MANNANASE user 2 3 # 2 A 50 ARG A 43 ARG~? 21.16 CL CL B 203 A 128 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 225 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 38.56 19.11 14.83 37.12 21.00 16.76 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 36.48 24.43 22.02 36.86 26.34 21.13 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 40.16 23.71 17.01 38.52 24.96 17.40 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1bqc_c01 BETA-MANNANASE user 3 3 # 3 A 50 ARG A 91 ARG~? 21.95 O3 SO4 A 201 A 128 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 225 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo 38.56 19.11 14.83 37.12 21.00 16.76 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 36.48 24.43 22.02 36.86 26.34 21.13 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 40.16 23.71 17.01 38.52 24.96 17.40 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1bqc_c01 BETA-MANNANASE user 4 3 # 4 A 50 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 128 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 225 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 38.56 19.11 14.83 37.12 21.00 16.76 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 36.48 24.43 22.02 36.86 26.34 21.13 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 40.16 23.71 17.01 38.52 24.96 17.40 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1bqc_c01 BETA-MANNANASE user 5 3 # 5 A 50 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 128 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 225 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 38.56 19.11 14.83 37.12 21.00 16.76 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 36.48 24.43 22.02 36.86 26.34 21.13 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 40.16 23.71 17.01 38.52 24.96 17.40 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1bqc_c01 BETA-MANNANASE user 6 3 # 6 A 50 ARG B 91 ARG~? 22.09 O1 SO4 B 202 A 128 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 225 GLU B 83 GLU^? 22.50 O1 SO4 B 202 coo 38.56 19.11 14.83 37.12 21.00 16.76 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 36.48 24.43 22.02 36.86 26.34 21.13 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 40.16 23.71 17.01 38.52 24.96 17.40 51.81 11.56 -14.99 53.08 11.18 -13.32 1bqc_c01 source 1bqc BETA-MANNANASE : 6 hits 1bqc_c01 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE A 105 PHE^? 22.35 O2 SO4 A 201 A 205 ASP A 136 ASP~? 33.35 CL CL B 203 A 236 LYS A 141 LYS~? 27.34 CL CL B 203 coo 4.14 2.10 36.34 6.69 3.08 36.92 18.62 48.46 -21.52 21.21 48.28 -20.49 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 2 3 # 2 A 109 PHE B 22 PHE^? 5.22 CL CL B 203 A 205 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 236 LYS B 49 LYS~? 17.28 CL CL B 203 coo 4.14 2.10 36.34 6.69 3.08 36.92 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 3 3 # 3 A 109 PHE B 22 PHE^? 5.22 CL CL B 203 A 205 ASP B 158 ASP.? 18.10 CL CL B 203 A 236 LYS B 49 LYS~? 17.28 CL CL B 203 coo 4.14 2.10 36.34 6.69 3.08 36.92 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 4 3 # 4 A 109 PHE B 105 PHE^? 22.46 CL CL B 203 A 205 ASP B 136 ASP~? 35.38 CL CL B 203 A 236 LYS B 141 LYS~? 32.09 CL CL B 203 coo 4.14 2.10 36.34 6.69 3.08 36.92 47.21 17.58 -18.67 44.58 18.10 -17.81 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 50.65 30.91 -26.07 50.03 31.36 -31.64 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 4 hits 1bs0_c01 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 138 GLN~? 27.25 CL CL B 203 A 91 LEU A 134 LEU.? 26.36 CL CL B 203 A 133 GLU A 137 GLU~? 32.46 CL CL B 203 coo 43.58 43.67 66.73 42.32 42.78 68.15 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 38.58 45.09 70.44 38.28 45.21 72.59 18.11 44.77 -27.67 19.05 42.82 -27.40 coo 44.05 36.87 70.65 43.15 38.64 69.97 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 138 GLN~? 27.25 CL CL B 203 A 91 LEU A 139 LEU~? 26.71 CL CL B 203 A 133 GLU A 137 GLU~? 32.46 CL CL B 203 coo 43.58 43.67 66.73 42.32 42.78 68.15 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 38.58 45.09 70.44 38.28 45.21 72.59 14.50 41.00 -28.04 13.48 41.98 -26.40 coo 44.05 36.87 70.65 43.15 38.64 69.97 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN B 56 GLN^? 14.86 O4 SO4 B 202 A 91 LEU B 55 LEU.? 14.27 O4 SO4 B 202 A 133 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 43.58 43.67 66.73 42.32 42.78 68.15 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 38.58 45.09 70.44 38.28 45.21 72.59 42.41 20.13 -7.17 43.34 19.25 -8.99 coo 44.05 36.87 70.65 43.15 38.64 69.97 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 4 3 # 4 A 50 GLN B 56 GLN^? 14.86 O4 SO4 B 202 A 91 LEU B 71 LEU^? 9.34 O4 SO4 B 202 A 133 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 43.58 43.67 66.73 42.32 42.78 68.15 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 38.58 45.09 70.44 38.28 45.21 72.59 41.42 15.71 -5.96 39.29 16.12 -5.49 coo 44.05 36.87 70.65 43.15 38.64 69.97 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 5 3 # 5 A 50 GLN B 138 GLN~? 26.29 CL CL B 203 A 91 LEU B 134 LEU.? 26.22 CL CL B 203 A 133 GLU B 137 GLU~? 34.50 CL CL B 203 coo 43.58 43.67 66.73 42.32 42.78 68.15 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 38.58 45.09 70.44 38.28 45.21 72.59 48.44 21.19 -24.90 47.63 23.22 -24.70 coo 44.05 36.87 70.65 43.15 38.64 69.97 51.72 26.55 -33.23 50.47 26.22 -34.95 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 6 3 # 6 A 50 GLN B 138 GLN~? 26.29 CL CL B 203 A 91 LEU B 139 LEU~? 29.79 CL CL B 203 A 133 GLU B 137 GLU~? 34.50 CL CL B 203 coo 43.58 43.67 66.73 42.32 42.78 68.15 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 38.58 45.09 70.44 38.28 45.21 72.59 52.36 24.38 -25.29 53.36 23.29 -23.69 coo 44.05 36.87 70.65 43.15 38.64 69.97 51.72 26.55 -33.23 50.47 26.22 -34.95 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 6 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 138 GLN~? 27.25 CL CL B 203 B 591 LEU A 134 LEU.? 26.36 CL CL B 203 B 633 GLU A 137 GLU~? 32.46 CL CL B 203 coo 88.06 44.34 57.19 89.06 45.53 55.74 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 86.70 48.66 52.61 87.15 48.69 50.51 18.11 44.77 -27.67 19.05 42.82 -27.40 coo 95.42 44.52 54.43 93.46 45.31 54.70 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN A 138 GLN~? 27.25 CL CL B 203 B 591 LEU A 139 LEU~? 26.71 CL CL B 203 B 633 GLU A 137 GLU~? 32.46 CL CL B 203 coo 88.06 44.34 57.19 89.06 45.53 55.74 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 86.70 48.66 52.61 87.15 48.69 50.51 14.50 41.00 -28.04 13.48 41.98 -26.40 coo 95.42 44.52 54.43 93.46 45.31 54.70 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 3 3 # 3 B 550 GLN B 56 GLN^? 14.86 O4 SO4 B 202 B 591 LEU B 55 LEU.? 14.27 O4 SO4 B 202 B 633 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 88.06 44.34 57.19 89.06 45.53 55.74 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 86.70 48.66 52.61 87.15 48.69 50.51 42.41 20.13 -7.17 43.34 19.25 -8.99 coo 95.42 44.52 54.43 93.46 45.31 54.70 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 4 3 # 4 B 550 GLN B 56 GLN^? 14.86 O4 SO4 B 202 B 591 LEU B 71 LEU^? 9.34 O4 SO4 B 202 B 633 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 88.06 44.34 57.19 89.06 45.53 55.74 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 86.70 48.66 52.61 87.15 48.69 50.51 41.42 15.71 -5.96 39.29 16.12 -5.49 coo 95.42 44.52 54.43 93.46 45.31 54.70 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 5 3 # 5 B 550 GLN B 138 GLN~? 26.29 CL CL B 203 B 591 LEU B 134 LEU.? 26.22 CL CL B 203 B 633 GLU B 137 GLU~? 34.50 CL CL B 203 coo 88.06 44.34 57.19 89.06 45.53 55.74 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 86.70 48.66 52.61 87.15 48.69 50.51 48.44 21.19 -24.90 47.63 23.22 -24.70 coo 95.42 44.52 54.43 93.46 45.31 54.70 51.72 26.55 -33.23 50.47 26.22 -34.95 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 6 3 # 6 B 550 GLN B 138 GLN~? 26.29 CL CL B 203 B 591 LEU B 139 LEU~? 29.79 CL CL B 203 B 633 GLU B 137 GLU~? 34.50 CL CL B 203 coo 88.06 44.34 57.19 89.06 45.53 55.74 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 86.70 48.66 52.61 87.15 48.69 50.51 52.36 24.38 -25.29 53.36 23.29 -23.69 coo 95.42 44.52 54.43 93.46 45.31 54.70 51.72 26.55 -33.23 50.47 26.22 -34.95 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 6 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 138 GLN~? 27.25 CL CL B 203 C1091 LEU A 134 LEU.? 26.36 CL CL B 203 C1133 GLU A 137 GLU~? 32.46 CL CL B 203 coo 68.29 34.44 43.03 66.67 34.74 44.37 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 65.83 38.95 47.05 65.46 38.90 49.20 18.11 44.77 -27.67 19.05 42.82 -27.40 coo 63.14 29.39 46.25 63.84 31.31 45.74 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN A 138 GLN~? 27.25 CL CL B 203 C1091 LEU A 139 LEU~? 26.71 CL CL B 203 C1133 GLU A 137 GLU~? 32.46 CL CL B 203 coo 68.29 34.44 43.03 66.67 34.74 44.37 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 65.83 38.95 47.05 65.46 38.90 49.20 14.50 41.00 -28.04 13.48 41.98 -26.40 coo 63.14 29.39 46.25 63.84 31.31 45.74 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 3 3 # 3 C1050 GLN B 56 GLN^? 14.86 O4 SO4 B 202 C1091 LEU B 55 LEU.? 14.27 O4 SO4 B 202 C1133 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 68.29 34.44 43.03 66.67 34.74 44.37 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 65.83 38.95 47.05 65.46 38.90 49.20 42.41 20.13 -7.17 43.34 19.25 -8.99 coo 63.14 29.39 46.25 63.84 31.31 45.74 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 4 3 # 4 C1050 GLN B 56 GLN^? 14.86 O4 SO4 B 202 C1091 LEU B 71 LEU^? 9.34 O4 SO4 B 202 C1133 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 68.29 34.44 43.03 66.67 34.74 44.37 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 65.83 38.95 47.05 65.46 38.90 49.20 41.42 15.71 -5.96 39.29 16.12 -5.49 coo 63.14 29.39 46.25 63.84 31.31 45.74 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 5 3 # 5 C1050 GLN B 138 GLN~? 26.29 CL CL B 203 C1091 LEU B 134 LEU.? 26.22 CL CL B 203 C1133 GLU B 137 GLU~? 34.50 CL CL B 203 coo 68.29 34.44 43.03 66.67 34.74 44.37 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 65.83 38.95 47.05 65.46 38.90 49.20 48.44 21.19 -24.90 47.63 23.22 -24.70 coo 63.14 29.39 46.25 63.84 31.31 45.74 51.72 26.55 -33.23 50.47 26.22 -34.95 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 6 3 # 6 C1050 GLN B 138 GLN~? 26.29 CL CL B 203 C1091 LEU B 139 LEU~? 29.79 CL CL B 203 C1133 GLU B 137 GLU~? 34.50 CL CL B 203 coo 68.29 34.44 43.03 66.67 34.74 44.37 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 65.83 38.95 47.05 65.46 38.90 49.20 52.36 24.38 -25.29 53.36 23.29 -23.69 coo 63.14 29.39 46.25 63.84 31.31 45.74 51.72 26.55 -33.23 50.47 26.22 -34.95 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 7 3 # 7 C1050 GLN B 138 GLN~? 26.29 CL CL B 203 C1091 LEU B 174 LEU.? 22.22 CL CL B 203 C1133 GLU B 171 GLU^? 23.59 CL CL B 203 coo 68.29 34.44 43.03 66.67 34.74 44.37 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 65.83 38.95 47.05 65.46 38.90 49.20 42.94 19.93 -24.01 44.00 20.58 -22.24 coo 63.14 29.39 46.25 63.84 31.31 45.74 39.63 28.73 -28.22 38.55 28.71 -30.01 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 7 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 138 GLN~? 27.25 CL CL B 203 A 91 LEU A 134 LEU.? 26.36 CL CL B 203 A 133 GLU A 137 GLU~? 32.46 CL CL B 203 coo 38.23 53.34 67.59 38.84 53.87 69.56 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 35.40 53.22 73.30 35.37 54.87 74.74 18.11 44.77 -27.67 19.05 42.82 -27.40 coo 45.08 56.04 70.60 43.15 55.19 70.77 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 138 GLN~? 27.25 CL CL B 203 A 91 LEU A 134 LEU.? 26.36 CL CL B 203 A 133 GLU A 171 GLU^? 26.34 CL CL B 203 coo 38.23 53.34 67.59 38.84 53.87 69.56 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 35.40 53.22 73.30 35.37 54.87 74.74 18.11 44.77 -27.67 19.05 42.82 -27.40 coo 45.08 56.04 70.60 43.15 55.19 70.77 28.18 38.40 -30.98 29.16 38.58 -32.86 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN A 138 GLN~? 27.25 CL CL B 203 A 91 LEU A 170 LEU^? 20.93 CL CL B 203 A 133 GLU A 137 GLU~? 32.46 CL CL B 203 coo 38.23 53.34 67.59 38.84 53.87 69.56 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 35.40 53.22 73.30 35.37 54.87 74.74 23.59 34.03 -27.76 21.99 35.22 -28.65 coo 45.08 56.04 70.60 43.15 55.19 70.77 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 4 3 # 4 A 50 GLN B 56 GLN^? 14.86 O4 SO4 B 202 A 91 LEU B 55 LEU.? 14.27 O4 SO4 B 202 A 133 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 38.23 53.34 67.59 38.84 53.87 69.56 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 35.40 53.22 73.30 35.37 54.87 74.74 42.41 20.13 -7.17 43.34 19.25 -8.99 coo 45.08 56.04 70.60 43.15 55.19 70.77 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 5 3 # 5 A 50 GLN B 56 GLN^? 14.86 O4 SO4 B 202 A 91 LEU B 71 LEU^? 9.34 O4 SO4 B 202 A 133 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo 38.23 53.34 67.59 38.84 53.87 69.56 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 35.40 53.22 73.30 35.37 54.87 74.74 41.42 15.71 -5.96 39.29 16.12 -5.49 coo 45.08 56.04 70.60 43.15 55.19 70.77 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 6 3 # 6 A 50 GLN B 138 GLN~? 26.29 CL CL B 203 A 91 LEU B 134 LEU.? 26.22 CL CL B 203 A 133 GLU B 137 GLU~? 34.50 CL CL B 203 coo 38.23 53.34 67.59 38.84 53.87 69.56 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 35.40 53.22 73.30 35.37 54.87 74.74 48.44 21.19 -24.90 47.63 23.22 -24.70 coo 45.08 56.04 70.60 43.15 55.19 70.77 51.72 26.55 -33.23 50.47 26.22 -34.95 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 7 3 # 7 A 50 GLN B 138 GLN~? 26.29 CL CL B 203 A 91 LEU B 134 LEU.? 26.22 CL CL B 203 A 133 GLU B 171 GLU^? 23.59 CL CL B 203 coo 38.23 53.34 67.59 38.84 53.87 69.56 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 35.40 53.22 73.30 35.37 54.87 74.74 48.44 21.19 -24.90 47.63 23.22 -24.70 coo 45.08 56.04 70.60 43.15 55.19 70.77 39.63 28.73 -28.22 38.55 28.71 -30.01 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 7 hits 1bsj_c00 naa= 3 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 # 1 A 325 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 354 GLU A 53 GLU.? 13.05 O2 SO4 A 201 A 421 ASP A 24 ASP^? 8.56 CL CL B 203 coo 31.05 49.37 64.51 31.97 51.11 63.85 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 29.07 50.42 58.36 29.02 52.18 59.49 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 30.82 59.76 58.47 31.12 59.02 60.40 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 2 3 # 2 A 325 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 354 GLU B 53 GLU.? 13.18 O4 SO4 B 202 A 421 ASP B 24 ASP^? 11.11 CL CL B 203 coo 31.05 49.37 64.51 31.97 51.11 63.85 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 29.07 50.42 58.36 29.02 52.18 59.49 38.06 24.56 -1.39 36.59 24.51 0.17 coo 30.82 59.76 58.47 31.12 59.02 60.40 37.06 32.38 -6.05 35.96 33.77 -7.20 1bvz_c08 source 1bvz ALPHA-AMYLASE II : 2 hits 1bvz_c08 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP A 52 ASP.? 10.10 O2 SO4 A 201 B 354 GLU A 53 GLU.? 13.05 O2 SO4 A 201 B 421 ASP A 24 ASP^? 8.56 CL CL B 203 coo 25.90 8.19 53.87 25.36 6.97 52.29 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 27.87 10.66 47.95 27.82 8.60 48.27 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 26.02 1.87 43.38 25.90 1.97 45.49 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 2 3 # 2 B 325 ASP B 52 ASP.? 10.23 O4 SO4 B 202 B 354 GLU B 53 GLU.? 13.18 O4 SO4 B 202 B 421 ASP B 24 ASP^? 11.11 CL CL B 203 coo 25.90 8.19 53.87 25.36 6.97 52.29 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 27.87 10.66 47.95 27.82 8.60 48.27 38.06 24.56 -1.39 36.59 24.51 0.17 coo 26.02 1.87 43.38 25.90 1.97 45.49 37.06 32.38 -6.05 35.96 33.77 -7.20 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 2 hits 1bvz_c09 naa= 3 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 1 3 # 1 71 ARG A 39 ARG~? 27.60 O2 SO4 A 201 127 ARG A 43 ARG~? 21.16 CL CL B 203 270 GLU A 66 GLU.? 18.87 O3 SO4 A 201 coo -0.83 25.63 1.57 0.97 28.05 0.90 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 10.83 52.69 -6.96 11.60 51.77 -5.23 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 2 3 # 2 71 ARG B 39 ARG~? 27.56 O4 SO4 B 202 127 ARG B 43 ARG~? 25.25 O4 SO4 B 202 270 GLU B 66 GLU.? 19.61 O1 SO4 B 202 coo -0.83 25.63 1.57 0.97 28.05 0.90 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 54.16 12.70 -3.87 54.28 14.29 -2.42 1cbx_c01 source 1cbx CARBOXYPEPTIDASE A (E.C.3.4.17.1) COMPLEX WITH: 2 hits 1cbx_c01 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 16 ASP^? 19.84 O2 SO4 A 201 264 GLU A 68 GLU.? 23.69 O2 SO4 A 201 328 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 59.69 92.71 39.85 58.53 92.03 41.47 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 45.39 90.72 40.63 45.07 89.14 41.90 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 52 ASP.? 10.10 O2 SO4 A 201 264 GLU A 66 GLU.? 18.87 O3 SO4 A 201 328 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 59.69 92.71 39.85 58.53 92.03 41.47 10.83 52.69 -6.96 11.60 51.77 -5.23 coo 45.39 90.72 40.63 45.07 89.14 41.90 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP A 52 ASP.? 10.10 O2 SO4 A 201 264 GLU A 83 GLU^? 22.48 O3 SO4 A 201 328 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 59.69 92.71 39.85 58.53 92.03 41.47 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 45.39 90.72 40.63 45.07 89.14 41.90 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 # 4 229 ASP A 74 ASP.? -4.21 O2 SO4 A 201s 264 GLU A 66 GLU.? 18.87 O3 SO4 A 201 328 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 29.24 55.36 0.45 30.25 53.50 0.45 coo 59.69 92.71 39.85 58.53 92.03 41.47 10.83 52.69 -6.96 11.60 51.77 -5.23 coo 45.39 90.72 40.63 45.07 89.14 41.90 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 5 3 # 5 229 ASP A 88 ASP~? 29.34 O3 SO4 A 201 264 GLU A 35 GLU.? 23.66 CL CL B 203 328 ASP A 65 ASP.? 22.23 O3 SO4 A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 59.69 92.71 39.85 58.53 92.03 41.47 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 45.39 90.72 40.63 45.07 89.14 41.90 7.01 55.74 -9.90 7.72 56.49 -8.05 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 6 3 # 6 229 ASP A 158 ASP.? 28.53 CL CL B 203 264 GLU A 101 GLU^? 12.83 O4 SO4 A 201 328 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 59.69 92.71 39.85 58.53 92.03 41.47 26.35 58.10 -15.33 27.91 56.97 -16.20 coo 45.39 90.72 40.63 45.07 89.14 41.90 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 7 3 # 7 229 ASP A 165 ASP.? 13.91 CL CL B 203 264 GLU B 171 GLU^? 23.59 CL CL B 203 328 ASP B 16 ASP^? 10.11 CL CL B 203 coo 45.62 80.42 43.69 45.65 82.01 45.07 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 59.69 92.71 39.85 58.53 92.03 41.47 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 45.39 90.72 40.63 45.07 89.14 41.90 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 8 3 # 8 229 ASP A 165 ASP.? 13.91 CL CL B 203 264 GLU B 171 GLU^? 23.59 CL CL B 203 328 ASP B 18 ASP.? 13.73 CL CL B 203 coo 45.62 80.42 43.69 45.65 82.01 45.07 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 59.69 92.71 39.85 58.53 92.03 41.47 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 45.39 90.72 40.63 45.07 89.14 41.90 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 9 3 # 9 229 ASP A 166 ASP.? 11.63 CL CL B 203 264 GLU B 101 GLU^? 13.49 O2 SO4 B 202 328 ASP B 16 ASP^? 10.11 CL CL B 203 coo 45.62 80.42 43.69 45.65 82.01 45.07 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 59.69 92.71 39.85 58.53 92.03 41.47 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 45.39 90.72 40.63 45.07 89.14 41.90 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 10 3 # 10 229 ASP A 166 ASP.? 11.63 CL CL B 203 264 GLU B 171 GLU^? 23.59 CL CL B 203 328 ASP B 16 ASP^? 10.11 CL CL B 203 coo 45.62 80.42 43.69 45.65 82.01 45.07 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 59.69 92.71 39.85 58.53 92.03 41.47 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 45.39 90.72 40.63 45.07 89.14 41.90 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 11 3 # 11 229 ASP B 16 ASP^? 10.11 CL CL B 203 264 GLU B 68 GLU.? 23.74 O4 SO4 B 202 328 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 45.62 80.42 43.69 45.65 82.01 45.07 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 59.69 92.71 39.85 58.53 92.03 41.47 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 45.39 90.72 40.63 45.07 89.14 41.90 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 12 3 # 12 229 ASP B 52 ASP.? 10.23 O4 SO4 B 202 264 GLU B 66 GLU.? 19.61 O1 SO4 B 202 328 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 45.62 80.42 43.69 45.65 82.01 45.07 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 59.69 92.71 39.85 58.53 92.03 41.47 54.16 12.70 -3.87 54.28 14.29 -2.42 coo 45.39 90.72 40.63 45.07 89.14 41.90 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 13 3 # 13 229 ASP B 52 ASP.? 10.23 O4 SO4 B 202 264 GLU B 83 GLU^? 22.50 O1 SO4 B 202 328 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 45.62 80.42 43.69 45.65 82.01 45.07 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 59.69 92.71 39.85 58.53 92.03 41.47 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 45.39 90.72 40.63 45.07 89.14 41.90 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 14 3 # 14 229 ASP B 74 ASP.? -3.98 O4 SO4 B 202s 264 GLU B 66 GLU.? 19.61 O1 SO4 B 202 328 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 45.62 80.42 43.69 45.65 82.01 45.07 35.83 12.25 3.35 35.06 14.20 3.07 coo 59.69 92.71 39.85 58.53 92.03 41.47 54.16 12.70 -3.87 54.28 14.29 -2.42 coo 45.39 90.72 40.63 45.07 89.14 41.90 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 15 3 # 15 229 ASP B 158 ASP.? 18.10 CL CL B 203 264 GLU B 101 GLU^? 13.49 O2 SO4 B 202 328 ASP B 16 ASP^? 10.11 CL CL B 203 coo 45.62 80.42 43.69 45.65 82.01 45.07 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 59.69 92.71 39.85 58.53 92.03 41.47 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 45.39 90.72 40.63 45.07 89.14 41.90 33.53 24.74 -14.92 33.82 22.97 -16.03 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 15 hits 1cdg_c00 naa= 3 ULMN 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 A 232 HIS A 32 HIS.? 29.45 CL CL B 203 A 262 GLU A 35 GLU.? 23.66 CL CL B 203 A 358 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 26.19 60.87 43.98 27.48 59.27 43.30 3.09 41.50 -11.72 1.06 42.02 -11.62 coo 27.13 54.07 50.45 26.96 54.19 48.35 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 27.06 50.43 44.36 27.99 52.27 44.74 13.06 47.55 -15.25 11.61 49.09 -15.60 1chm_c00 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 1 hits 1chm_c00 naa= 3 ULMN 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 B 232 HIS A 32 HIS.? 29.45 CL CL B 203 B 262 GLU A 35 GLU.? 23.66 CL CL B 203 B 358 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 44.98 77.01 48.39 44.42 78.67 47.18 3.09 41.50 -11.72 1.06 42.02 -11.62 coo 41.60 83.57 54.16 42.46 83.24 52.25 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 44.05 87.61 48.73 43.15 85.67 48.52 13.06 47.55 -15.25 11.61 49.09 -15.60 1chm_c01 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 1 hits 1chm_c01 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU B 38 GLU~? 33.41 CL CL B 203 A 89 GLU B 137 GLU~? 34.50 CL CL B 203 A 120 SER B 109 SER~? 35.44 CL CL B 203 coo -24.35 9.53 67.64 -25.07 11.29 68.60 56.16 26.15 -22.68 57.22 25.29 -24.33 coo -31.18 6.91 75.60 -32.39 8.51 74.91 51.72 26.55 -33.23 50.47 26.22 -34.95 coo -34.73 8.57 68.21 -33.63 9.08 70.28 55.00 17.36 -30.57 53.91 19.30 -31.57 ULMN 3 1cns_c00 CHITINASE user 2 3 # 2 A 67 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 89 GLU B 101 GLU^? 13.49 O2 SO4 B 202 A 120 SER B 130 SER^? 19.34 O2 SO4 B 202 coo -24.35 9.53 67.64 -25.07 11.29 68.60 51.81 11.56 -14.99 53.08 11.18 -13.32 coo -31.18 6.91 75.60 -32.39 8.51 74.91 39.44 10.40 -13.31 37.47 11.26 -13.58 coo -34.73 8.57 68.21 -33.63 9.08 70.28 42.41 10.17 -19.59 40.20 10.78 -18.92 1cns_c00 source 1cns CHITINASE : 2 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 38 GLU~? 28.10 CL CL B 203 B 89 GLU A 137 GLU~? 32.46 CL CL B 203 B 120 SER A 109 SER~? 36.36 CL CL B 203 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 15.44 38.60 -35.89 16.74 38.72 -37.58 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 11.05 47.60 -32.89 11.53 46.95 -35.16 ULMN 3 1cns_c01 CHITINASE user 2 3 # 2 B 67 GLU B 38 GLU~? 33.41 CL CL B 203 B 89 GLU B 137 GLU~? 34.50 CL CL B 203 B 120 SER B 109 SER~? 35.44 CL CL B 203 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 55.00 17.36 -30.57 53.91 19.30 -31.57 ULMN 3 1cns_c01 CHITINASE user 3 3 # 3 B 67 GLU B 83 GLU^? 22.50 O1 SO4 B 202 B 89 GLU B 101 GLU^? 13.49 O2 SO4 B 202 B 120 SER B 130 SER^? 19.34 O2 SO4 B 202 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 42.41 10.17 -19.59 40.20 10.78 -18.92 1cns_c01 source 1cns CHITINASE : 3 hits 1cns_c01 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 8 TYR^? 17.88 CL CL B 203 A 173 ASP A 147 ASP.? 14.36 CL CL B 203 C 48 ARG A 43 ARG~? 21.16 CL CL B 203 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 24.35 4.55 25.11 25.94 3.23 25.53 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 101 TYR B 8 TYR^? 29.42 CL CL B 203 A 173 ASP B 147 ASP.? 29.53 CL CL B 203 C 48 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 24.35 4.55 25.11 25.94 3.23 25.53 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 52.54 21.81 -11.81 54.35 23.52 -10.03 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 43 ARG~? 21.16 CL CL B 203 C 101 TYR A 8 TYR^? 17.88 CL CL B 203 C 173 ASP A 147 ASP.? 14.36 CL CL B 203 coo 32.27 5.62 48.15 31.93 6.48 51.06 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 29.64 3.64 57.39 31.22 5.14 55.65 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 48 ARG B 43 ARG~? 25.25 O4 SO4 B 202 C 101 TYR B 8 TYR^? 29.42 CL CL B 203 C 173 ASP B 147 ASP.? 29.53 CL CL B 203 coo 32.27 5.62 48.15 31.93 6.48 51.06 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 29.64 3.64 57.39 31.22 5.14 55.65 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 52.99 37.46 -14.27 53.96 39.20 -13.53 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 43 ARG~? 21.16 CL CL B 203 D 101 TYR A 8 TYR^? 17.88 CL CL B 203 D 173 ASP A 147 ASP.? 14.36 CL CL B 203 coo 69.08 8.58 32.60 69.70 10.81 30.58 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 71.77 11.86 24.26 70.23 12.22 26.56 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 71.60 6.14 19.25 70.26 6.87 20.69 16.08 28.22 -17.17 15.39 26.23 -17.08 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 8 TYR^? 17.88 CL CL B 203 B 173 ASP A 147 ASP.? 14.36 CL CL B 203 D 48 ARG A 43 ARG~? 21.16 CL CL B 203 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 101 TYR B 8 TYR^? 29.42 CL CL B 203 B 173 ASP B 147 ASP.? 29.53 CL CL B 203 D 48 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 52.54 21.81 -11.81 54.35 23.52 -10.03 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c03 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 56 ILE A 82 ILE^? 17.93 O2 SO4 A 201 A 82 TYR A 50 TYR~? 16.99 O2 SO4 A 201 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 18.99 50.06 -15.19 19.90 48.99 -15.73 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 25.15 49.16 -16.65 24.90 50.91 -18.81 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 56 ILE B 82 ILE^? 18.15 O4 SO4 B 202 A 82 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 46.80 16.07 -12.36 46.05 17.26 -12.83 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 40.69 17.69 -13.90 40.63 15.92 -16.06 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 2 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 79 ASP^? 5.34 O4 SO4 A 201 B 56 ILE A 82 ILE^? 17.93 O2 SO4 A 201 B 82 TYR A 50 TYR~? 16.99 O2 SO4 A 201 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 18.99 50.06 -15.19 19.90 48.99 -15.73 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 25.15 49.16 -16.65 24.90 50.91 -18.81 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP B 79 ASP^? 5.64 O2 SO4 B 202 B 56 ILE B 82 ILE^? 18.15 O4 SO4 B 202 B 82 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 46.80 16.07 -12.36 46.05 17.26 -12.83 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 40.69 17.69 -13.90 40.63 15.92 -16.06 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 2 hits 1d6o_c01 naa= 3 ULMN 3 1d7r_c01 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 138 TRP A 115 TRP~? 30.09 O4 SO4 A 201 A 243 ASP A 88 ASP~? 29.34 O3 SO4 A 201 A 272 LYS A 122 LYS~? 33.55 O4 SO4 A 201 coo 18.21 54.75 18.05 19.91 55.17 21.59 9.03 56.91 -26.77 12.93 56.71 -26.19 coo 16.93 55.67 9.65 17.16 54.23 11.19 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 14.13 45.79 13.40 14.25 49.41 18.30 14.46 65.90 -26.67 9.45 67.99 -27.93 ULMN 3 1d7r_c01 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 2 3 # 2 A 138 TRP B 115 TRP~? 30.44 O1 SO4 B 202 A 243 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 272 LYS B 122 LYS~? 34.58 O2 SO4 B 202 coo 18.21 54.75 18.05 19.91 55.17 21.59 55.54 8.04 -24.08 51.69 8.57 -23.51 coo 16.93 55.67 9.65 17.16 54.23 11.19 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 14.13 45.79 13.40 14.25 49.41 18.30 48.89 -0.01 -23.68 54.40 -1.08 -26.39 1d7r_c01 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 2 hits 1d7r_c01 naa= 3 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 173 TYR A 8 TYR^? 17.88 CL CL B 203 A 243 ASP A 65 ASP.? 22.23 O3 SO4 A 201 A 272 LYS A 94 LYS~? 22.47 O3 SO4 A 201 coo 2.03 68.31 21.46 0.66 68.36 23.90 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 16.93 55.67 9.65 17.16 54.23 11.19 7.01 55.74 -9.90 7.72 56.49 -8.05 coo 14.13 45.79 13.40 14.25 49.41 18.30 12.51 62.07 -13.42 8.27 61.24 -10.02 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 2 3 # 2 A 173 TYR A 133 TYR^? 32.81 O4 SO4 A 201 A 243 ASP A 165 ASP.? 13.91 CL CL B 203 A 272 LYS A 9 LYS^? 13.80 CL CL B 203 coo 2.03 68.31 21.46 0.66 68.36 23.90 17.01 49.27 -30.66 15.25 47.83 -32.31 coo 16.93 55.67 9.65 17.16 54.23 11.19 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.13 45.79 13.40 14.25 49.41 18.30 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 3 3 # 3 A 173 TYR B 8 TYR^? 29.42 CL CL B 203 A 243 ASP B 65 ASP.? 21.45 O1 SO4 B 202 A 272 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo 2.03 68.31 21.46 0.66 68.36 23.90 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 16.93 55.67 9.65 17.16 54.23 11.19 57.62 9.59 -5.23 56.36 8.07 -4.49 coo 14.13 45.79 13.40 14.25 49.41 18.30 51.38 3.18 -10.50 55.68 5.47 -6.55 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 4 3 # 4 A 173 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 243 ASP A 165 ASP.? 13.91 CL CL B 203 A 272 LYS A 9 LYS^? 13.80 CL CL B 203 coo 2.03 68.31 21.46 0.66 68.36 23.90 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 16.93 55.67 9.65 17.16 54.23 11.19 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.13 45.79 13.40 14.25 49.41 18.30 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 5 3 # 5 A 173 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 243 ASP B 147 ASP.? 29.53 CL CL B 203 A 272 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 2.03 68.31 21.46 0.66 68.36 23.90 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 16.93 55.67 9.65 17.16 54.23 11.19 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 14.13 45.79 13.40 14.25 49.41 18.30 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 6 3 # 6 A 173 TYR B 133 TYR^? 31.17 CL CL B 203 A 243 ASP B 165 ASP.? 24.35 CL CL B 203 A 272 LYS B 9 LYS^? 26.01 CL CL B 203 coo 2.03 68.31 21.46 0.66 68.36 23.90 48.83 16.45 -27.74 50.79 17.58 -29.40 coo 16.93 55.67 9.65 17.16 54.23 11.19 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 14.13 45.79 13.40 14.25 49.41 18.30 50.82 33.22 -7.07 51.79 32.01 -1.71 1d7r_c02 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 6 hits 1d7r_c02 naa= 3 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 A 145 LYS A 141 LYS~? 27.34 CL CL B 203 A 177 GLU A 171 GLU^? 26.34 CL CL B 203 A 201 LEU A 170 LEU^? 20.93 CL CL B 203 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 23.59 34.03 -27.76 21.99 35.22 -28.65 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 A 145 LYS B 141 LYS~? 32.09 CL CL B 203 A 177 GLU B 171 GLU^? 23.59 CL CL B 203 A 201 LEU B 170 LEU^? 24.58 CL CL B 203 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 44.49 32.76 -25.09 45.88 31.26 -25.95 1daa_c00 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c00 naa= 3 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 B 145 LYS A 141 LYS~? 27.34 CL CL B 203 B 177 GLU A 171 GLU^? 26.34 CL CL B 203 B 201 LEU A 170 LEU^? 20.93 CL CL B 203 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 27.00 6.35 51.01 26.30 4.53 50.18 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 23.74 1.68 49.50 22.87 -0.24 49.97 23.59 34.03 -27.76 21.99 35.22 -28.65 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 B 145 LYS B 141 LYS~? 32.09 CL CL B 203 B 177 GLU B 171 GLU^? 23.59 CL CL B 203 B 201 LEU B 170 LEU^? 24.58 CL CL B 203 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 27.00 6.35 51.01 26.30 4.53 50.18 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 23.74 1.68 49.50 22.87 -0.24 49.97 44.49 32.76 -25.09 45.88 31.26 -25.95 1daa_c01 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c01 naa= 3 ULMN 3 1dhp_c01 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 B 133 TYR A 8 TYR^? 17.88 CL CL B 203 B 138 ARG A 43 ARG~? 21.16 CL CL B 203 B 161 LYS A 9 LYS^? 13.80 CL CL B 203 coo 4.62 122.69 99.88 5.46 122.82 97.24 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 10.44 122.27 94.08 11.02 123.87 91.53 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -0.17 119.75 99.65 2.51 123.83 95.70 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1dhp_c01 DIHYDRODIPICOLINATE SYNTHASE user 2 3 # 2 B 133 TYR B 8 TYR^? 29.42 CL CL B 203 B 138 ARG B 43 ARG~? 25.25 O4 SO4 B 202 B 161 LYS B 9 LYS^? 26.01 CL CL B 203 coo 4.62 122.69 99.88 5.46 122.82 97.24 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 10.44 122.27 94.08 11.02 123.87 91.53 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -0.17 119.75 99.65 2.51 123.83 95.70 50.82 33.22 -7.07 51.79 32.01 -1.71 1dhp_c01 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 2 hits 1dhp_c01 naa= 3 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 1 3 # 1 146 TYR A 50 TYR~? 16.99 O2 SO4 A 201 150 LYS A 49 LYS~? 21.61 O2 SO4 A 201 186 ASN A 73 ASN.? -3.54 O3 SO4 A 201s coo 32.88 50.55 24.33 31.89 51.78 26.65 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 27.04 52.42 22.30 26.88 49.99 27.00 26.03 45.00 -18.94 27.16 48.58 -22.77 coo 36.98 50.30 37.29 35.85 50.29 35.50 27.08 56.20 -4.04 25.99 58.02 -3.77 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 2 3 # 2 146 TYR A 50 TYR~? 16.99 O2 SO4 A 201 150 LYS A 49 LYS~? 21.61 O2 SO4 A 201 186 ASN A 128 ASN.? 15.88 O4 SO4 A 201 coo 32.88 50.55 24.33 31.89 51.78 26.65 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 27.04 52.42 22.30 26.88 49.99 27.00 26.03 45.00 -18.94 27.16 48.58 -22.77 coo 36.98 50.30 37.29 35.85 50.29 35.50 23.73 62.15 -16.98 21.71 62.36 -16.27 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 3 3 # 3 146 TYR B 50 TYR~? 17.17 O4 SO4 B 202 150 LYS B 49 LYS~? 17.28 CL CL B 203 186 ASN B 73 ASN.? -3.57 O1 SO4 B 202s coo 32.88 50.55 24.33 31.89 51.78 26.65 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 27.04 52.42 22.30 26.88 49.99 27.00 40.33 21.93 -16.14 38.56 18.89 -19.75 coo 36.98 50.30 37.29 35.85 50.29 35.50 37.83 10.96 -1.17 38.79 9.10 -0.83 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 4 3 # 4 146 TYR B 50 TYR~? 17.17 O4 SO4 B 202 150 LYS B 49 LYS~? 17.28 CL CL B 203 186 ASN B 128 ASN.? 16.24 O2 SO4 B 202 coo 32.88 50.55 24.33 31.89 51.78 26.65 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 27.04 52.42 22.30 26.88 49.99 27.00 40.33 21.93 -16.14 38.56 18.89 -19.75 coo 36.98 50.30 37.29 35.85 50.29 35.50 40.54 4.79 -14.04 42.49 4.20 -13.37 1dhr_c00 source 1dhr DIHYDROPTERIDINE REDUCTASE (DHPR) (E.C.1.6.99.: 4 hits 1dhr_c00 naa= 3 ULMN 3 1diz_c00 3-METHYLADENINE DNA GLYCOSYLASE II user 1 3 # 1 A 222 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 238 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 272 TRP A 47 TRP~? 16.38 CL CL B 203 coo -17.92 42.46 111.37 -18.35 40.11 109.91 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -25.50 44.84 112.68 -25.52 43.37 111.17 27.85 46.96 -9.87 29.03 47.89 -8.38 coo -27.19 39.29 113.01 -23.27 39.61 112.78 21.59 43.66 -11.80 24.90 41.61 -11.24 ULMN 3 1diz_c00 3-METHYLADENINE DNA GLYCOSYLASE II user 2 3 # 2 A 222 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 238 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 272 TRP B 47 TRP~? 16.22 CL CL B 203 coo -17.92 42.46 111.37 -18.35 40.11 109.91 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -25.50 44.84 112.68 -25.52 43.37 111.17 38.35 20.38 -6.97 37.13 19.67 -5.41 coo -27.19 39.29 113.01 -23.27 39.61 112.78 44.90 22.85 -9.04 41.88 25.32 -8.53 1diz_c00 source 1diz 3-METHYLADENINE DNA GLYCOSYLASE II : 2 hits 1diz_c00 naa= 3 ULMN 3 1diz_c01 3-METHYLADENINE DNA GLYCOSYLASE II user 1 3 # 1 B 222 TYR A 50 TYR~? 16.99 O2 SO4 A 201 B 238 ASP A 52 ASP.? 10.10 O2 SO4 A 201 B 272 TRP A 47 TRP~? 16.38 CL CL B 203 coo 17.91 42.42 121.64 18.26 40.06 123.11 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 25.38 44.99 120.20 25.38 43.50 121.71 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 27.19 39.35 120.02 23.28 39.60 120.23 21.59 43.66 -11.80 24.90 41.61 -11.24 ULMN 3 1diz_c01 3-METHYLADENINE DNA GLYCOSYLASE II user 2 3 # 2 B 222 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B 238 ASP B 52 ASP.? 10.23 O4 SO4 B 202 B 272 TRP B 47 TRP~? 16.22 CL CL B 203 coo 17.91 42.42 121.64 18.26 40.06 123.11 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 25.38 44.99 120.20 25.38 43.50 121.71 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 27.19 39.35 120.02 23.28 39.60 120.23 44.90 22.85 -9.04 41.88 25.32 -8.53 1diz_c01 source 1diz 3-METHYLADENINE DNA GLYCOSYLASE II : 2 hits 1diz_c01 naa= 3 ULMN 3 1dnp_c00 DNA PHOTOLYASE user 1 3 # 1 A 306 TRP A 116 TRP~? 30.82 O4 SO4 A 201 A 359 TRP A 177 TRP^? 30.87 O4 SO4 A 201 A 382 TRP A 132 TRP^? 22.33 O4 SO4 A 201 coo 31.27 39.47 20.74 28.54 37.06 22.19 15.99 57.29 -32.97 17.59 58.53 -29.59 coo 30.66 36.51 25.88 33.61 35.64 28.35 19.75 53.60 -31.66 15.88 53.16 -31.11 coo 29.03 37.53 34.46 26.37 39.52 32.35 22.11 51.17 -22.96 25.69 51.25 -24.63 ULMN 3 1dnp_c00 DNA PHOTOLYASE user 2 3 # 2 A 306 TRP A 177 TRP^? 30.87 O4 SO4 A 201 A 359 TRP A 116 TRP~? 30.82 O4 SO4 A 201 A 382 TRP A 115 TRP~? 30.09 O4 SO4 A 201 coo 31.27 39.47 20.74 28.54 37.06 22.19 19.75 53.60 -31.66 15.88 53.16 -31.11 coo 30.66 36.51 25.88 33.61 35.64 28.35 15.99 57.29 -32.97 17.59 58.53 -29.59 coo 29.03 37.53 34.46 26.37 39.52 32.35 9.03 56.91 -26.77 12.93 56.71 -26.19 ULMN 3 1dnp_c00 DNA PHOTOLYASE user 3 3 # 3 A 306 TRP B 116 TRP~? 30.79 O2 SO4 B 202 A 359 TRP B 177 TRP^? 31.12 O2 SO4 B 202 A 382 TRP B 132 TRP^? 21.63 CL CL B 203 coo 31.27 39.47 20.74 28.54 37.06 22.19 48.41 8.58 -29.86 46.96 7.30 -26.44 coo 30.66 36.51 25.88 33.61 35.64 28.35 45.60 12.61 -28.85 49.46 12.52 -28.08 coo 29.03 37.53 34.46 26.37 39.52 32.35 43.22 15.26 -20.02 39.85 15.72 -22.02 1dnp_c00 source 1dnp DNA PHOTOLYASE : 3 hits 1dnp_c00 naa= 3 ULMN 3 1dnp_c01 DNA PHOTOLYASE user 1 3 # 1 B 306 TRP A 116 TRP~? 30.82 O4 SO4 A 201 B 359 TRP A 177 TRP^? 30.87 O4 SO4 A 201 B 382 TRP A 132 TRP^? 22.33 O4 SO4 A 201 coo 46.11 60.68 29.45 45.44 64.17 31.12 15.99 57.29 -32.97 17.59 58.53 -29.59 coo 42.23 65.07 28.50 40.25 65.66 25.15 19.75 53.60 -31.66 15.88 53.16 -31.11 coo 33.75 67.27 29.24 35.04 65.70 32.64 22.11 51.17 -22.96 25.69 51.25 -24.63 ULMN 3 1dnp_c01 DNA PHOTOLYASE user 2 3 # 2 B 306 TRP A 177 TRP^? 30.87 O4 SO4 A 201 B 359 TRP A 116 TRP~? 30.82 O4 SO4 A 201 B 382 TRP A 115 TRP~? 30.09 O4 SO4 A 201 coo 46.11 60.68 29.45 45.44 64.17 31.12 19.75 53.60 -31.66 15.88 53.16 -31.11 coo 42.23 65.07 28.50 40.25 65.66 25.15 15.99 57.29 -32.97 17.59 58.53 -29.59 coo 33.75 67.27 29.24 35.04 65.70 32.64 9.03 56.91 -26.77 12.93 56.71 -26.19 ULMN 3 1dnp_c01 DNA PHOTOLYASE user 3 3 # 3 B 306 TRP B 116 TRP~? 30.79 O2 SO4 B 202 B 359 TRP B 177 TRP^? 31.12 O2 SO4 B 202 B 382 TRP B 132 TRP^? 21.63 CL CL B 203 coo 46.11 60.68 29.45 45.44 64.17 31.12 48.41 8.58 -29.86 46.96 7.30 -26.44 coo 42.23 65.07 28.50 40.25 65.66 25.15 45.60 12.61 -28.85 49.46 12.52 -28.08 coo 33.75 67.27 29.24 35.04 65.70 32.64 43.22 15.26 -20.02 39.85 15.72 -22.02 1dnp_c01 source 1dnp DNA PHOTOLYASE : 3 hits 1dnp_c01 naa= 3 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 # 1 B 141 GLY A 85 GLY.? 28.21 O2 SO4 A 201 B 144 GLU A 83 GLU^? 22.48 O3 SO4 A 201 B 164 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 88.87 114.43 152.30 88.45 115.15 152.32 10.86 50.47 -22.49 11.53 50.96 -22.46 coo 85.20 111.99 152.05 86.60 110.89 150.91 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 88.14 113.46 145.73 86.79 113.92 147.30 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 2 3 # 2 B 141 GLY B 85 GLY.? 28.32 O4 SO4 B 202 B 144 GLU B 83 GLU^? 22.50 O1 SO4 B 202 B 164 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 88.87 114.43 152.30 88.45 115.15 152.32 54.76 14.35 -19.53 54.03 13.99 -19.56 coo 85.20 111.99 152.05 86.60 110.89 150.91 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 88.14 113.46 145.73 86.79 113.92 147.30 52.13 16.66 -12.75 54.11 15.89 -12.66 1dub_c13 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c13 naa= 3 ULMN 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 # 1 C 141 GLY A 85 GLY.? 28.21 O2 SO4 A 201 C 144 GLU A 83 GLU^? 22.48 O3 SO4 A 201 C 164 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 56.28 104.55 135.84 56.09 105.34 136.05 10.86 50.47 -22.49 11.53 50.96 -22.46 coo 58.46 103.90 139.48 57.57 102.00 139.16 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 51.71 102.03 140.09 53.02 103.62 140.54 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 # 2 C 141 GLY B 85 GLY.? 28.32 O4 SO4 B 202 C 144 GLU B 83 GLU^? 22.50 O1 SO4 B 202 C 164 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 56.28 104.55 135.84 56.09 105.34 136.05 54.76 14.35 -19.53 54.03 13.99 -19.56 coo 58.46 103.90 139.48 57.57 102.00 139.16 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 51.71 102.03 140.09 53.02 103.62 140.54 52.13 16.66 -12.75 54.11 15.89 -12.66 1dub_c14 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c14 naa= 3 ULMN 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 # 1 D 141 GLY A 85 GLY.? 28.21 O2 SO4 A 201 D 144 GLU A 83 GLU^? 22.48 O3 SO4 A 201 D 164 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 86.19 80.64 132.77 86.38 79.85 132.93 10.86 50.47 -22.49 11.53 50.96 -22.46 coo 84.75 81.24 136.88 85.62 83.14 136.43 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 91.47 83.05 136.24 90.35 81.38 136.84 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 # 2 D 141 GLY B 85 GLY.? 28.32 O4 SO4 B 202 D 144 GLU B 83 GLU^? 22.50 O1 SO4 B 202 D 164 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 86.19 80.64 132.77 86.38 79.85 132.93 54.76 14.35 -19.53 54.03 13.99 -19.56 coo 84.75 81.24 136.88 85.62 83.14 136.43 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 91.47 83.05 136.24 90.35 81.38 136.84 52.13 16.66 -12.75 54.11 15.89 -12.66 1dub_c15 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c15 naa= 3 ULMN 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 # 1 E 141 GLY A 85 GLY.? 28.21 O2 SO4 A 201 E 144 GLU A 83 GLU^? 22.48 O3 SO4 A 201 E 164 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 90.07 81.07 170.50 90.23 80.26 170.38 10.86 50.47 -22.49 11.53 50.96 -22.46 coo 87.05 81.30 167.53 86.38 82.74 168.94 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 84.40 80.02 173.80 85.08 79.06 172.03 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1dub_c16 2-ENOYL-COA HYDRATASE user 2 3 # 2 E 141 GLY B 85 GLY.? 28.32 O4 SO4 B 202 E 144 GLU B 83 GLU^? 22.50 O1 SO4 B 202 E 164 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 90.07 81.07 170.50 90.23 80.26 170.38 54.76 14.35 -19.53 54.03 13.99 -19.56 coo 87.05 81.30 167.53 86.38 82.74 168.94 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 84.40 80.02 173.80 85.08 79.06 172.03 52.13 16.66 -12.75 54.11 15.89 -12.66 1dub_c16 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c16 naa= 3 ULMN 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 # 1 F 141 GLY A 85 GLY.? 28.21 O2 SO4 A 201 F 144 GLU A 83 GLU^? 22.48 O3 SO4 A 201 F 164 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 57.12 70.68 155.10 57.52 69.95 155.02 10.86 50.47 -22.49 11.53 50.96 -22.46 coo 60.62 73.13 154.21 59.05 74.26 153.35 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 56.75 71.71 148.46 58.44 71.01 149.54 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 # 2 F 141 GLY B 85 GLY.? 28.32 O4 SO4 B 202 F 144 GLU B 83 GLU^? 22.50 O1 SO4 B 202 F 164 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 57.12 70.68 155.10 57.52 69.95 155.02 54.76 14.35 -19.53 54.03 13.99 -19.56 coo 60.62 73.13 154.21 59.05 74.26 153.35 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 56.75 71.71 148.46 58.44 71.01 149.54 52.13 16.66 -12.75 54.11 15.89 -12.66 1dub_c17 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c17 naa= 3 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 40 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 103 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 40 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 103 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 40 ASP B 16 ASP^? 10.11 CL CL B 203 A 103 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 40 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 103 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 38.35 20.38 -6.97 37.13 19.67 -5.41 1e3v_c02 source 1e3v STEROID DELTA-ISOMERASE : 4 hits 1e3v_c02 naa= 3 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 B 40 ASP A 16 ASP^? 19.84 O2 SO4 A 201 B 103 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 B 40 ASP A 79 ASP^? 5.34 O4 SO4 A 201 B 103 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B 40 ASP B 16 ASP^? 10.11 CL CL B 203 B 103 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B 40 ASP B 79 ASP^? 5.64 O2 SO4 B 202 B 103 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 38.35 20.38 -6.97 37.13 19.67 -5.41 1e3v_c03 source 1e3v STEROID DELTA-ISOMERASE : 4 hits 1e3v_c03 naa= 3 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 1 3 # 1 A 107 ALA A 30 ALA^? 21.24 CL CL B 203 A 136 TYR A 8 TYR^? 17.88 CL CL B 203 A 140 LYS A 9 LYS^? 13.80 CL CL B 203 coo 55.90 7.49 23.83 56.71 8.23 22.76 10.56 38.47 -9.51 10.10 39.20 -8.26 coo 59.38 10.02 17.51 59.95 9.89 20.21 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 59.52 3.69 18.67 62.31 6.19 22.58 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 2 3 # 2 A 107 ALA A 51 ALA.? 16.68 CL CL B 203 A 136 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 140 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 55.90 7.49 23.83 56.71 8.23 22.76 27.24 44.22 -13.46 28.03 42.99 -13.87 coo 59.38 10.02 17.51 59.95 9.89 20.21 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 59.52 3.69 18.67 62.31 6.19 22.58 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 3 3 # 3 A 107 ALA B 30 ALA^? 27.08 O4 SO4 B 202 A 136 TYR B 8 TYR^? 29.42 CL CL B 203 A 140 LYS B 9 LYS^? 26.01 CL CL B 203 coo 55.90 7.49 23.83 56.71 8.23 22.76 56.72 26.39 -6.61 57.09 25.56 -5.39 coo 59.38 10.02 17.51 59.95 9.89 20.21 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 59.52 3.69 18.67 62.31 6.19 22.58 50.82 33.22 -7.07 51.79 32.01 -1.71 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 4 3 # 4 A 107 ALA B 51 ALA.? 11.87 CL CL B 203 A 136 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 140 LYS B 49 LYS~? 17.28 CL CL B 203 coo 55.90 7.49 23.83 56.71 8.23 22.76 39.36 22.85 -10.60 38.84 24.20 -11.02 coo 59.38 10.02 17.51 59.95 9.89 20.21 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 59.52 3.69 18.67 62.31 6.19 22.58 40.33 21.93 -16.14 38.56 18.89 -19.75 1e7q_c01 source 1e7q GDP-FUCOSE SYNTHETASE : 4 hits 1e7q_c01 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 111 ALA~? 36.44 O4 SO4 A 201 A 257 ALA A 112 ALA~? 33.45 O4 SO4 A 201 A 328 ASP A 135 ASP~? 30.53 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 7.08 51.06 -31.33 6.61 50.50 -30.00 coo 43.22 26.73 5.37 41.81 27.09 5.79 10.69 52.22 -30.73 11.84 51.26 -30.49 coo 38.17 34.10 6.67 37.72 32.06 6.84 16.71 44.39 -33.44 18.14 42.86 -33.63 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA A 111 ALA~? 36.44 O4 SO4 A 201 A 257 ALA A 112 ALA~? 33.45 O4 SO4 A 201 A 328 ASP A 136 ASP~? 33.35 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 7.08 51.06 -31.33 6.61 50.50 -30.00 coo 43.22 26.73 5.37 41.81 27.09 5.79 10.69 52.22 -30.73 11.84 51.26 -30.49 coo 38.17 34.10 6.67 37.72 32.06 6.84 12.11 41.85 -33.23 10.81 43.53 -32.98 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 # 3 A 229 ALA A 112 ALA~? 33.45 O4 SO4 A 201 A 257 ALA A 111 ALA~? 36.44 O4 SO4 A 201 A 328 ASP A 136 ASP~? 33.35 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 10.69 52.22 -30.73 11.84 51.26 -30.49 coo 43.22 26.73 5.37 41.81 27.09 5.79 7.08 51.06 -31.33 6.61 50.50 -30.00 coo 38.17 34.10 6.67 37.72 32.06 6.84 12.11 41.85 -33.23 10.81 43.53 -32.98 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 # 4 A 229 ALA A 144 ALA~? 20.95 CL CL B 203 A 257 ALA A 146 ALA.? 18.24 CL CL B 203 A 328 ASP A 165 ASP.? 13.91 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 15.44 31.66 -25.02 16.01 31.13 -26.35 coo 43.22 26.73 5.37 41.81 27.09 5.79 15.11 31.88 -19.73 13.75 32.44 -20.04 coo 38.17 34.10 6.67 37.72 32.06 6.84 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 5 3 # 5 A 229 ALA A 146 ALA.? 18.24 CL CL B 203 A 257 ALA A 144 ALA~? 20.95 CL CL B 203 A 328 ASP A 165 ASP.? 13.91 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 15.11 31.88 -19.73 13.75 32.44 -20.04 coo 43.22 26.73 5.37 41.81 27.09 5.79 15.44 31.66 -25.02 16.01 31.13 -26.35 coo 38.17 34.10 6.67 37.72 32.06 6.84 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 6 3 # 6 A 229 ALA A 154 ALA^? 14.81 CL CL B 203 A 257 ALA A 15 ALA^? 15.74 CL CL B 203 A 328 ASP A 24 ASP^? 8.56 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 28.91 36.74 -19.76 27.90 37.81 -19.35 coo 43.22 26.73 5.37 41.81 27.09 5.79 34.01 39.06 -17.24 34.91 37.94 -17.73 coo 38.17 34.10 6.67 37.72 32.06 6.84 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 7 3 # 7 A 229 ALA B 111 ALA~? 36.75 O1 SO4 B 202 A 257 ALA B 112 ALA~? 33.71 O2 SO4 B 202 A 328 ASP B 135 ASP~? 30.33 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 58.44 13.32 -28.53 59.07 13.74 -27.20 coo 43.22 26.73 5.37 41.81 27.09 5.79 54.69 12.77 -27.96 53.71 13.86 -27.54 coo 38.17 34.10 6.67 37.72 32.06 6.84 49.61 21.30 -30.64 48.45 23.04 -30.81 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 8 3 # 8 A 229 ALA B 111 ALA~? 36.75 O1 SO4 B 202 A 257 ALA B 112 ALA~? 33.71 O2 SO4 B 202 A 328 ASP B 136 ASP~? 35.38 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 58.44 13.32 -28.53 59.07 13.74 -27.20 coo 43.22 26.73 5.37 41.81 27.09 5.79 54.69 12.77 -27.96 53.71 13.86 -27.54 coo 38.17 34.10 6.67 37.72 32.06 6.84 54.69 22.94 -30.23 55.58 21.02 -29.87 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 9 3 # 9 A 229 ALA B 112 ALA~? 33.71 O2 SO4 B 202 A 257 ALA B 111 ALA~? 36.75 O1 SO4 B 202 A 328 ASP B 136 ASP~? 35.38 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 54.69 12.77 -27.96 53.71 13.86 -27.54 coo 43.22 26.73 5.37 41.81 27.09 5.79 58.44 13.32 -28.53 59.07 13.74 -27.20 coo 38.17 34.10 6.67 37.72 32.06 6.84 54.69 22.94 -30.23 55.58 21.02 -29.87 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 10 3 # 10 A 229 ALA B 144 ALA~? 29.67 CL CL B 203 A 257 ALA B 146 ALA.? 28.63 CL CL B 203 A 328 ASP B 165 ASP.? 24.35 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 52.84 33.66 -22.26 52.38 34.23 -23.60 coo 43.22 26.73 5.37 41.81 27.09 5.79 53.17 33.58 -16.83 54.37 32.69 -17.09 coo 38.17 34.10 6.67 37.72 32.06 6.84 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 11 3 # 11 A 229 ALA B 146 ALA.? 28.63 CL CL B 203 A 257 ALA B 144 ALA~? 29.67 CL CL B 203 A 328 ASP B 165 ASP.? 24.35 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 53.17 33.58 -16.83 54.37 32.69 -17.09 coo 43.22 26.73 5.37 41.81 27.09 5.79 52.84 33.66 -22.26 52.38 34.23 -23.60 coo 38.17 34.10 6.67 37.72 32.06 6.84 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 12 3 # 12 A 229 ALA B 154 ALA^? 14.54 CL CL B 203 A 257 ALA B 15 ALA^? 9.07 CL CL B 203 A 328 ASP B 18 ASP.? 13.73 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 38.72 30.85 -17.27 39.54 29.64 -16.86 coo 43.22 26.73 5.37 41.81 27.09 5.79 33.44 29.49 -14.78 32.88 30.75 -15.46 coo 38.17 34.10 6.67 37.72 32.06 6.84 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 13 3 # 13 A 229 ALA B 154 ALA^? 14.54 CL CL B 203 A 257 ALA B 15 ALA^? 9.07 CL CL B 203 A 328 ASP B 24 ASP^? 11.11 CL CL B 203 coo 39.84 24.12 8.44 38.50 24.23 9.11 38.72 30.85 -17.27 39.54 29.64 -16.86 coo 43.22 26.73 5.37 41.81 27.09 5.79 33.44 29.49 -14.78 32.88 30.75 -15.46 coo 38.17 34.10 6.67 37.72 32.06 6.84 37.06 32.38 -6.05 35.96 33.77 -7.20 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 13 hits 1eo7_c00 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP A 135 ASP~? 30.53 CL CL B 203 260 GLU A 38 GLU~? 28.10 CL CL B 203 370 TYR A 107 TYR.? 29.41 CL CL B 203 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 12.10 46.09 -25.36 9.95 46.06 -23.57 ULMN 3 1euu_c00 SIALIDASE user 2 3 # 2 92 ASP B 135 ASP~? 30.33 CL CL B 203 260 GLU B 38 GLU~? 33.41 CL CL B 203 370 TYR B 107 TYR.? 30.85 O4 SO4 B 202 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 54.19 18.98 -22.56 56.19 18.89 -20.60 1euu_c00 source 1euu SIALIDASE : 2 hits 1euu_c00 naa= 3 ULMN 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 3 # 1 C 95 ASP A 136 ASP~? 33.35 CL CL B 203 C 117 GLU A 38 GLU~? 28.10 CL CL B 203 C 131 GLU A 137 GLU~? 32.46 CL CL B 203 coo 68.01 56.37 72.57 68.42 56.10 70.51 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 66.59 62.50 67.44 67.57 60.64 67.12 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 69.24 52.27 71.96 69.91 50.26 71.89 15.44 38.60 -35.89 16.74 38.72 -37.58 ULMN 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 2 3 # 2 C 95 ASP B 136 ASP~? 35.38 CL CL B 203 C 117 GLU B 38 GLU~? 33.41 CL CL B 203 C 131 GLU B 137 GLU~? 34.50 CL CL B 203 coo 68.01 56.37 72.57 68.42 56.10 70.51 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 66.59 62.50 67.44 67.57 60.64 67.12 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 69.24 52.27 71.96 69.91 50.26 71.89 51.72 26.55 -33.23 50.47 26.22 -34.95 1f6d_c02 source 1f6d UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE : 2 hits 1f6d_c02 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE B 22 PHE^? 5.22 CL CL B 203 A 210 ASP A 165 ASP.? 13.91 CL CL B 203 A 244 LYS A 9 LYS^? 13.80 CL CL B 203 coo 9.23 46.77 25.11 11.48 48.39 24.76 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 10.51 37.86 19.71 9.07 39.38 20.04 23.54 28.49 -20.46 22.55 27.96 -22.28 coo -1.20 42.34 17.67 3.19 45.13 19.06 17.34 32.48 -9.89 16.06 33.15 -4.52 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 1 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE B 22 PHE^? 5.22 CL CL B 203 B 210 ASP A 165 ASP.? 13.91 CL CL B 203 B 244 LYS A 9 LYS^? 13.80 CL CL B 203 coo 8.76 47.85 34.91 11.08 46.36 35.41 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 9.06 56.85 40.30 7.71 55.27 39.90 23.54 28.49 -20.46 22.55 27.96 -22.28 coo -2.38 51.82 41.62 2.07 49.19 40.42 17.34 32.48 -9.89 16.06 33.15 -4.52 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 1 hits 1fc4_c03 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 142 LEU A 71 LEU^? 9.11 O2 SO4 A 201 A 165 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 24.32 51.19 -8.85 26.47 51.20 -8.48 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 142 LEU A 104 LEU^? 23.59 O4 SO4 A 201 A 165 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 16.98 54.40 -21.54 14.89 54.63 -22.04 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 142 LEU B 71 LEU^? 9.34 O4 SO4 B 202 A 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 41.42 15.71 -5.96 39.29 16.12 -5.49 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 A 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 142 LEU B 104 LEU^? 23.96 O2 SO4 B 202 A 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 48.17 11.47 -18.56 50.16 11.02 -19.41 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 40.33 21.93 -16.14 38.56 18.89 -19.75 1fdy_c00 source 1fdy N-ACETYLNEURAMINATE LYASE : 4 hits 1fdy_c00 naa= 3 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 137 TYR A 50 TYR~? 16.99 O2 SO4 A 201 B 142 LEU A 71 LEU^? 9.11 O2 SO4 A 201 B 165 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 24.32 51.19 -8.85 26.47 51.20 -8.48 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR A 50 TYR~? 16.99 O2 SO4 A 201 B 142 LEU A 104 LEU^? 23.59 O4 SO4 A 201 B 165 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 16.98 54.40 -21.54 14.89 54.63 -22.04 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 B 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B 142 LEU B 71 LEU^? 9.34 O4 SO4 B 202 B 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 41.42 15.71 -5.96 39.29 16.12 -5.49 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 B 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B 142 LEU B 104 LEU^? 23.96 O2 SO4 B 202 B 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 48.17 11.47 -18.56 50.16 11.02 -19.41 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 40.33 21.93 -16.14 38.56 18.89 -19.75 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 4 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR A 50 TYR~? 16.99 O2 SO4 A 201 C 142 LEU A 71 LEU^? 9.11 O2 SO4 A 201 C 165 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 24.32 51.19 -8.85 26.47 51.20 -8.48 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 C 142 LEU B 71 LEU^? 9.34 O4 SO4 B 202 C 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 41.42 15.71 -5.96 39.29 16.12 -5.49 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 C 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 C 142 LEU B 104 LEU^? 23.96 O2 SO4 B 202 C 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 48.17 11.47 -18.56 50.16 11.02 -19.41 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 40.33 21.93 -16.14 38.56 18.89 -19.75 1fdy_c02 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c02 naa= 3 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 137 TYR A 50 TYR~? 16.99 O2 SO4 A 201 D 142 LEU A 71 LEU^? 9.11 O2 SO4 A 201 D 165 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 24.32 51.19 -8.85 26.47 51.20 -8.48 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR A 50 TYR~? 16.99 O2 SO4 A 201 D 142 LEU A 104 LEU^? 23.59 O4 SO4 A 201 D 165 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 25.15 49.16 -16.65 24.90 50.91 -18.81 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 16.98 54.40 -21.54 14.89 54.63 -22.04 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 D 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 D 142 LEU B 71 LEU^? 9.34 O4 SO4 B 202 D 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 41.42 15.71 -5.96 39.29 16.12 -5.49 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 D 137 TYR B 50 TYR~? 17.17 O4 SO4 B 202 D 142 LEU B 104 LEU^? 23.96 O2 SO4 B 202 D 165 LYS B 49 LYS~? 17.28 CL CL B 203 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 40.69 17.69 -13.90 40.63 15.92 -16.06 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 48.17 11.47 -18.56 50.16 11.02 -19.41 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 40.33 21.93 -16.14 38.56 18.89 -19.75 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 4 hits 1fdy_c03 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 136 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 246 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 13.48 30.30 107.06 11.75 30.99 109.44 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 9.46 32.37 115.82 8.50 34.20 115.47 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 11.99 34.33 109.92 10.08 34.19 110.77 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 43 ARG~? 21.16 CL CL B 203 A 136 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 246 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 13.48 30.30 107.06 11.75 30.99 109.44 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 9.46 32.37 115.82 8.50 34.20 115.47 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 11.99 34.33 109.92 10.08 34.19 110.77 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG A 91 ARG~? 21.95 O3 SO4 A 201 A 136 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 246 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo 13.48 30.30 107.06 11.75 30.99 109.44 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 9.46 32.37 115.82 8.50 34.20 115.47 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 11.99 34.33 109.92 10.08 34.19 110.77 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 136 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 246 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 13.48 30.30 107.06 11.75 30.99 109.44 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 9.46 32.37 115.82 8.50 34.20 115.47 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 11.99 34.33 109.92 10.08 34.19 110.77 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 5 3 # 5 A 45 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 136 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 246 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 13.48 30.30 107.06 11.75 30.99 109.44 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 9.46 32.37 115.82 8.50 34.20 115.47 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 11.99 34.33 109.92 10.08 34.19 110.77 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 6 3 # 6 A 45 ARG B 91 ARG~? 22.09 O1 SO4 B 202 A 136 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 246 GLU B 83 GLU^? 22.50 O1 SO4 B 202 coo 13.48 30.30 107.06 11.75 30.99 109.44 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 9.46 32.37 115.82 8.50 34.20 115.47 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 11.99 34.33 109.92 10.08 34.19 110.77 51.81 11.56 -14.99 53.08 11.18 -13.32 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 6 hits 1fhl_c00 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 136 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 246 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 13.94 29.84 106.80 11.67 30.40 108.79 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 9.52 31.97 115.23 8.45 33.74 114.72 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 11.92 33.82 109.35 10.10 33.50 110.39 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 43 ARG~? 21.16 CL CL B 203 A 136 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 246 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 13.94 29.84 106.80 11.67 30.40 108.79 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 9.52 31.97 115.23 8.45 33.74 114.72 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 11.92 33.82 109.35 10.10 33.50 110.39 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG A 91 ARG~? 21.95 O3 SO4 A 201 A 136 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 246 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo 13.94 29.84 106.80 11.67 30.40 108.79 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 9.52 31.97 115.23 8.45 33.74 114.72 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 11.92 33.82 109.35 10.10 33.50 110.39 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 136 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 246 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 13.94 29.84 106.80 11.67 30.40 108.79 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 9.52 31.97 115.23 8.45 33.74 114.72 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 11.92 33.82 109.35 10.10 33.50 110.39 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 5 3 # 5 A 45 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 136 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 246 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 13.94 29.84 106.80 11.67 30.40 108.79 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 9.52 31.97 115.23 8.45 33.74 114.72 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 11.92 33.82 109.35 10.10 33.50 110.39 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 6 3 # 6 A 45 ARG B 91 ARG~? 22.09 O1 SO4 B 202 A 136 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 246 GLU B 83 GLU^? 22.50 O1 SO4 B 202 coo 13.94 29.84 106.80 11.67 30.40 108.79 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 9.52 31.97 115.23 8.45 33.74 114.72 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 11.92 33.82 109.35 10.10 33.50 110.39 51.81 11.56 -14.99 53.08 11.18 -13.32 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 6 hits 1fob_c00 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU B 38 GLU~? 33.41 CL CL B 203 B 319 ASP B 136 ASP~? 35.38 CL CL B 203 B 359 ARG B 110 ARG~? 44.21 CL CL B 203 coo 10.77 13.13 40.94 11.03 14.73 39.51 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 3.77 12.64 38.21 3.35 14.53 37.39 54.69 22.94 -30.23 55.58 21.02 -29.87 coo -1.16 15.32 35.60 -3.32 13.56 36.98 60.95 18.14 -32.42 62.40 18.76 -35.07 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 # 2 B 317 GLU B 137 GLU~? 34.50 CL CL B 203 B 319 ASP B 136 ASP~? 35.38 CL CL B 203 B 359 ARG B 110 ARG~? 44.21 CL CL B 203 coo 10.77 13.13 40.94 11.03 14.73 39.51 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 3.77 12.64 38.21 3.35 14.53 37.39 54.69 22.94 -30.23 55.58 21.02 -29.87 coo -1.16 15.32 35.60 -3.32 13.56 36.98 60.95 18.14 -32.42 62.40 18.76 -35.07 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 2 hits 1fr8_c01 naa= 3 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 1 3 # 1 A 314 TRP A 81 TRP^? 17.53 O3 SO4 A 201 A 317 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 365 ARG A 72 ARG^? 12.89 O3 SO4 A 201 coo 79.91 26.87 38.77 78.95 23.18 37.81 16.50 54.91 -14.14 14.33 56.78 -11.43 coo 85.55 26.30 41.25 85.59 24.97 39.65 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 83.47 25.30 27.10 83.44 27.82 25.29 19.61 53.07 -4.13 17.97 51.61 -1.95 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 2 3 # 2 A 314 TRP A 81 TRP^? 17.53 O3 SO4 A 201 A 317 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 365 ARG A 72 ARG^? 12.89 O3 SO4 A 201 coo 79.91 26.87 38.77 78.95 23.18 37.81 16.50 54.91 -14.14 14.33 56.78 -11.43 coo 85.55 26.30 41.25 85.59 24.97 39.65 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 83.47 25.30 27.10 83.44 27.82 25.29 19.61 53.07 -4.13 17.97 51.61 -1.95 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 3 3 # 3 A 314 TRP B 81 TRP^? 17.38 O1 SO4 B 202 A 317 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 365 ARG B 72 ARG^? 12.97 O1 SO4 B 202 coo 79.91 26.87 38.77 78.95 23.18 37.81 48.58 10.75 -11.23 50.31 8.75 -8.31 coo 85.55 26.30 41.25 85.59 24.97 39.65 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 83.47 25.30 27.10 83.44 27.82 25.29 45.42 12.48 -0.13 47.39 14.66 0.83 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 4 3 # 4 A 314 TRP B 81 TRP^? 17.38 O1 SO4 B 202 A 317 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 365 ARG B 72 ARG^? 12.97 O1 SO4 B 202 coo 79.91 26.87 38.77 78.95 23.18 37.81 48.58 10.75 -11.23 50.31 8.75 -8.31 coo 85.55 26.30 41.25 85.59 24.97 39.65 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 83.47 25.30 27.10 83.44 27.82 25.29 45.42 12.48 -0.13 47.39 14.66 0.83 1g8o_c01 source 1g8o N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALACTOSYLTRA: 4 hits 1g8o_c01 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU B 101 GLU^? 13.49 O2 SO4 B 202 A 47 ASP B 18 ASP.? 13.73 CL CL B 203 A 161 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo 37.12 18.35 73.76 37.09 16.69 72.44 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 29.81 8.06 73.13 30.21 10.11 72.95 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 37.29 15.56 67.90 37.37 13.79 70.08 40.69 17.69 -13.90 40.63 15.92 -16.06 1geq_c02 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c02 naa= 3 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 B 36 GLU B 101 GLU^? 13.49 O2 SO4 B 202 B 47 ASP B 18 ASP.? 13.73 CL CL B 203 B 161 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo 53.87 35.49 53.22 55.44 35.72 54.61 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 63.47 43.65 53.95 61.45 43.07 54.06 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 56.38 35.81 59.19 58.25 35.77 57.10 40.69 17.69 -13.90 40.63 15.92 -16.06 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c03 naa= 3 ULMN 3 1grc_c02 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 # 1 A 106 ASN A 73 ASN.? -3.54 O3 SO4 A 201s A 108 HIS A 75 HIS.? -3.80 O3 SO4 A 201s A 144 ASP A 74 ASP.? -4.21 O2 SO4 A 201s coo 51.28 61.14 17.85 51.16 61.61 19.96 27.08 56.20 -4.04 25.99 58.02 -3.77 coo 52.62 57.63 23.12 50.77 57.51 22.26 27.80 60.20 0.72 29.73 60.52 1.48 coo 46.65 56.95 20.09 48.42 58.17 20.01 29.24 55.36 0.45 30.25 53.50 0.45 ULMN 3 1grc_c02 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 2 3 # 2 A 106 ASN B 73 ASN.? -3.57 O1 SO4 B 202s A 108 HIS B 75 HIS.? -3.77 O1 SO4 B 202s A 144 ASP B 74 ASP.? -3.98 O4 SO4 B 202s coo 51.28 61.14 17.85 51.16 61.61 19.96 37.83 10.96 -1.17 38.79 9.10 -0.83 coo 52.62 57.63 23.12 50.77 57.51 22.26 36.52 7.25 3.52 34.54 7.26 4.22 coo 46.65 56.95 20.09 48.42 58.17 20.01 35.83 12.25 3.35 35.06 14.20 3.07 1grc_c02 source 1grc GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE (E.C: 2 hits 1grc_c02 naa= 3 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 1 3 # 1 160 LYS A 94 LYS~? 22.47 O3 SO4 A 201 210 ARG A 39 ARG~? 27.60 O2 SO4 A 201 225 ARG A 43 ARG~? 21.16 CL CL B 203 coo 17.51 28.50 73.42 17.24 23.02 75.86 12.51 62.07 -13.42 8.27 61.24 -10.02 coo 24.74 11.56 73.05 25.29 14.32 71.80 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 27.81 15.44 77.10 25.66 16.50 75.19 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS A 94 LYS~? 22.47 O3 SO4 A 201 210 ARG A 43 ARG~? 21.16 CL CL B 203 225 ARG A 39 ARG~? 27.60 O2 SO4 A 201 coo 17.51 28.50 73.42 17.24 23.02 75.86 12.51 62.07 -13.42 8.27 61.24 -10.02 coo 24.74 11.56 73.05 25.29 14.32 71.80 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 27.81 15.44 77.10 25.66 16.50 75.19 9.26 44.73 -19.12 9.60 47.81 -19.09 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 3 3 # 3 160 LYS A 141 LYS~? 27.34 CL CL B 203 210 ARG A 43 ARG~? 21.16 CL CL B 203 225 ARG A 39 ARG~? 27.60 O2 SO4 A 201 coo 17.51 28.50 73.42 17.24 23.02 75.86 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 24.74 11.56 73.05 25.29 14.32 71.80 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 27.81 15.44 77.10 25.66 16.50 75.19 9.26 44.73 -19.12 9.60 47.81 -19.09 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 4 3 # 4 160 LYS A 141 LYS~? 27.34 CL CL B 203 210 ARG A 148 ARG.? 18.96 CL CL B 203 225 ARG A 31 ARG^? 24.05 CL CL B 203 coo 17.51 28.50 73.42 17.24 23.02 75.86 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 24.74 11.56 73.05 25.29 14.32 71.80 10.63 29.23 -12.53 8.60 28.94 -10.24 coo 27.81 15.44 77.10 25.66 16.50 75.19 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 5 3 # 5 160 LYS B 94 LYS~? 21.71 O1 SO4 B 202 210 ARG B 39 ARG~? 27.56 O4 SO4 B 202 225 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 17.51 28.50 73.42 17.24 23.02 75.86 51.38 3.18 -10.50 55.68 5.47 -6.55 coo 24.74 11.56 73.05 25.29 14.32 71.80 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 27.81 15.44 77.10 25.66 16.50 75.19 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 6 3 # 6 160 LYS B 94 LYS~? 21.71 O1 SO4 B 202 210 ARG B 43 ARG~? 25.25 O4 SO4 B 202 225 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo 17.51 28.50 73.42 17.24 23.02 75.86 51.38 3.18 -10.50 55.68 5.47 -6.55 coo 24.74 11.56 73.05 25.29 14.32 71.80 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 27.81 15.44 77.10 25.66 16.50 75.19 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 7 3 # 7 160 LYS B 141 LYS~? 32.09 CL CL B 203 210 ARG B 43 ARG~? 25.25 O4 SO4 B 202 225 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo 17.51 28.50 73.42 17.24 23.02 75.86 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 24.74 11.56 73.05 25.29 14.32 71.80 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 27.81 15.44 77.10 25.66 16.50 75.19 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 8 3 # 8 160 LYS B 141 LYS~? 32.09 CL CL B 203 210 ARG B 148 ARG.? 33.47 CL CL B 203 225 ARG B 31 ARG^? 34.85 CL CL B 203 coo 17.51 28.50 73.42 17.24 23.02 75.86 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 24.74 11.56 73.05 25.29 14.32 71.80 58.77 36.06 -9.99 59.77 35.32 -7.22 coo 27.81 15.44 77.10 25.66 16.50 75.19 59.17 28.21 -12.86 61.91 28.73 -14.07 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 8 hits 1gsa_c00 naa= 3 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 A 189 PHE A 22 PHE^? 18.06 CL CL B 203 A 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 329 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 2.59 0.29 25.55 4.65 0.18 25.07 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 12.42 6.10 23.27 9.95 1.57 20.16 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 A 189 PHE A 22 PHE^? 18.06 CL CL B 203 A 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 329 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 2.59 0.29 25.55 4.65 0.18 25.07 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 12.42 6.10 23.27 9.95 1.57 20.16 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 A 189 PHE B 22 PHE^? 5.22 CL CL B 203 A 298 ASP A 165 ASP.? 13.91 CL CL B 203 A 329 LYS A 9 LYS^? 13.80 CL CL B 203 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 2.59 0.29 25.55 4.65 0.18 25.07 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 12.42 6.10 23.27 9.95 1.57 20.16 17.34 32.48 -9.89 16.06 33.15 -4.52 1gtx_c00 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c00 naa= 3 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 B 189 PHE A 22 PHE^? 18.06 CL CL B 203 B 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 B 329 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 B 189 PHE A 22 PHE^? 18.06 CL CL B 203 B 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 B 329 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 B 189 PHE B 22 PHE^? 5.22 CL CL B 203 B 298 ASP A 165 ASP.? 13.91 CL CL B 203 B 329 LYS A 9 LYS^? 13.80 CL CL B 203 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 17.34 32.48 -9.89 16.06 33.15 -4.52 1gtx_c01 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c01 naa= 3 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 C 189 PHE A 22 PHE^? 18.06 CL CL B 203 C 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 C 329 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 17.41 60.57 64.39 18.40 58.12 65.34 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 24.10 66.43 63.33 24.18 64.30 63.40 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 27.64 56.61 58.17 22.18 57.92 60.36 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 C 189 PHE A 22 PHE^? 18.06 CL CL B 203 C 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 C 329 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 17.41 60.57 64.39 18.40 58.12 65.34 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 24.10 66.43 63.33 24.18 64.30 63.40 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 27.64 56.61 58.17 22.18 57.92 60.36 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 C 189 PHE B 22 PHE^? 5.22 CL CL B 203 C 298 ASP A 165 ASP.? 13.91 CL CL B 203 C 329 LYS A 9 LYS^? 13.80 CL CL B 203 coo 17.41 60.57 64.39 18.40 58.12 65.34 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 24.10 66.43 63.33 24.18 64.30 63.40 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 27.64 56.61 58.17 22.18 57.92 60.36 17.34 32.48 -9.89 16.06 33.15 -4.52 1gtx_c02 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c02 naa= 3 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 D 189 PHE A 22 PHE^? 18.06 CL CL B 203 D 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 D 329 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 35.44 53.35 83.81 35.65 54.53 81.28 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 29.72 46.46 83.60 30.79 47.36 81.99 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 36.89 44.91 74.55 37.33 48.94 79.01 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 D 189 PHE A 22 PHE^? 18.06 CL CL B 203 D 298 ASP A 18 ASP.? 23.99 O2 SO4 A 201 D 329 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 35.44 53.35 83.81 35.65 54.53 81.28 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 29.72 46.46 83.60 30.79 47.36 81.99 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 36.89 44.91 74.55 37.33 48.94 79.01 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 D 189 PHE B 22 PHE^? 5.22 CL CL B 203 D 298 ASP A 165 ASP.? 13.91 CL CL B 203 D 329 LYS A 9 LYS^? 13.80 CL CL B 203 coo 35.44 53.35 83.81 35.65 54.53 81.28 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 29.72 46.46 83.60 30.79 47.36 81.99 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 36.89 44.91 74.55 37.33 48.94 79.01 17.34 32.48 -9.89 16.06 33.15 -4.52 1gtx_c03 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c03 naa= 3 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 1 3 # 1 A 271 GLN A 37 GLN~? 21.48 CL CL B 203 A 296 GLU A 35 GLU.? 23.66 CL CL B 203 A 383 TYR A 107 TYR.? 29.41 CL CL B 203 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 10.48 34.34 -20.54 10.63 32.45 -21.50 coo 40.93 4.45 2.36 38.91 3.75 2.26 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 30.54 7.22 6.23 31.38 5.79 3.97 12.10 46.09 -25.36 9.95 46.06 -23.57 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 2 3 # 2 A 271 GLN A 138 GLN~? 27.25 CL CL B 203 A 296 GLU A 137 GLU~? 32.46 CL CL B 203 A 383 TYR A 107 TYR.? 29.41 CL CL B 203 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 40.93 4.45 2.36 38.91 3.75 2.26 15.44 38.60 -35.89 16.74 38.72 -37.58 coo 30.54 7.22 6.23 31.38 5.79 3.97 12.10 46.09 -25.36 9.95 46.06 -23.57 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 3 3 # 3 A 271 GLN B 37 GLN~? 31.96 CL CL B 203 A 296 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 383 TYR B 107 TYR.? 30.85 O4 SO4 B 202 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 57.18 30.22 -17.87 57.50 32.05 -18.86 coo 40.93 4.45 2.36 38.91 3.75 2.26 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 30.54 7.22 6.23 31.38 5.79 3.97 54.19 18.98 -22.56 56.19 18.89 -20.60 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 4 3 # 4 A 271 GLN B 138 GLN~? 26.29 CL CL B 203 A 296 GLU B 137 GLU~? 34.50 CL CL B 203 A 383 TYR B 107 TYR.? 30.85 O4 SO4 B 202 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 40.93 4.45 2.36 38.91 3.75 2.26 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 30.54 7.22 6.23 31.38 5.79 3.97 54.19 18.98 -22.56 56.19 18.89 -20.60 1h19_c00 source 1h19 LEUKOTRIENE A-4 HYDROLASE : 4 hits 1h19_c00 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 74 ASP.? -4.21 O2 SO4 A 201s A 327 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 339 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo 85.81 57.99 116.01 86.03 55.86 115.89 29.24 55.36 0.45 30.25 53.50 0.45 coo 75.11 41.01 160.30 76.65 40.06 161.41 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 82.23 40.35 159.87 85.09 40.67 161.01 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 327 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 339 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo 85.81 57.99 116.01 86.03 55.86 115.89 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 75.11 41.01 160.30 76.65 40.06 161.41 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 82.23 40.35 159.87 85.09 40.67 161.01 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 # 3 A 50 ASP A 135 ASP~? 30.53 CL CL B 203 A 327 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 339 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 85.81 57.99 116.01 86.03 55.86 115.89 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 75.11 41.01 160.30 76.65 40.06 161.41 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 82.23 40.35 159.87 85.09 40.67 161.01 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 # 4 A 50 ASP B 24 ASP^? 11.11 CL CL B 203 A 327 GLU A 89 GLU~? 32.07 O4 SO4 A 201 A 339 ARG A 90 ARG~? 30.13 O3 SO4 A 201 coo 85.81 57.99 116.01 86.03 55.86 115.89 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 75.11 41.01 160.30 76.65 40.06 161.41 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 82.23 40.35 159.87 85.09 40.67 161.01 5.35 65.69 -16.45 4.68 68.72 -16.26 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 5 3 # 5 A 50 ASP B 135 ASP~? 30.33 CL CL B 203 A 327 GLU A 35 GLU.? 23.66 CL CL B 203 A 339 ARG A 31 ARG^? 24.05 CL CL B 203 coo 85.81 57.99 116.01 86.03 55.86 115.89 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 75.11 41.01 160.30 76.65 40.06 161.41 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 82.23 40.35 159.87 85.09 40.67 161.01 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 6 3 # 6 A 50 ASP B 135 ASP~? 30.33 CL CL B 203 A 327 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 339 ARG A 39 ARG~? 27.60 O2 SO4 A 201 coo 85.81 57.99 116.01 86.03 55.86 115.89 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 75.11 41.01 160.30 76.65 40.06 161.41 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 82.23 40.35 159.87 85.09 40.67 161.01 9.26 44.73 -19.12 9.60 47.81 -19.09 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 7 3 # 7 A 50 ASP B 165 ASP.? 24.35 CL CL B 203 A 327 GLU A 89 GLU~? 32.07 O4 SO4 A 201 A 339 ARG A 90 ARG~? 30.13 O3 SO4 A 201 coo 85.81 57.99 116.01 86.03 55.86 115.89 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 75.11 41.01 160.30 76.65 40.06 161.41 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 82.23 40.35 159.87 85.09 40.67 161.01 5.35 65.69 -16.45 4.68 68.72 -16.26 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 7 hits 1hto_c00 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 12 VAL^? 9.52 CL CL B 203 A 200 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 226 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 19.13 38.05 1.41 19.72 38.80 -0.53 26.07 34.59 -13.11 24.69 36.29 -13.06 coo 24.51 43.28 11.18 25.17 44.50 9.58 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 34.47 51.09 7.19 28.58 51.18 7.53 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1i29_c03 CSDB user 2 3 # 2 A 128 VAL A 12 VAL^? 9.52 CL CL B 203 A 200 ASP B 24 ASP^? 11.11 CL CL B 203 A 226 LYS B 49 LYS~? 17.28 CL CL B 203 coo 19.13 38.05 1.41 19.72 38.80 -0.53 26.07 34.59 -13.11 24.69 36.29 -13.06 coo 24.51 43.28 11.18 25.17 44.50 9.58 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 34.47 51.09 7.19 28.58 51.18 7.53 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1i29_c03 CSDB user 3 3 # 3 A 128 VAL A 14 VAL^? 14.01 CL CL B 203 A 200 ASP A 165 ASP.? 13.91 CL CL B 203 A 226 LYS A 141 LYS~? 27.34 CL CL B 203 coo 19.13 38.05 1.41 19.72 38.80 -0.53 30.68 38.30 -15.66 29.30 40.02 -15.71 coo 24.51 43.28 11.18 25.17 44.50 9.58 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 34.47 51.09 7.19 28.58 51.18 7.53 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1i29_c03 CSDB user 4 3 # 4 A 128 VAL A 14 VAL^? 14.01 CL CL B 203 A 200 ASP B 24 ASP^? 11.11 CL CL B 203 A 226 LYS B 9 LYS^? 26.01 CL CL B 203 coo 19.13 38.05 1.41 19.72 38.80 -0.53 30.68 38.30 -15.66 29.30 40.02 -15.71 coo 24.51 43.28 11.18 25.17 44.50 9.58 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 34.47 51.09 7.19 28.58 51.18 7.53 50.82 33.22 -7.07 51.79 32.01 -1.71 ULMN 3 1i29_c03 CSDB user 5 3 # 5 A 128 VAL A 14 VAL^? 14.01 CL CL B 203 A 200 ASP B 24 ASP^? 11.11 CL CL B 203 A 226 LYS B 49 LYS~? 17.28 CL CL B 203 coo 19.13 38.05 1.41 19.72 38.80 -0.53 30.68 38.30 -15.66 29.30 40.02 -15.71 coo 24.51 43.28 11.18 25.17 44.50 9.58 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 34.47 51.09 7.19 28.58 51.18 7.53 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1i29_c03 CSDB user 6 3 # 6 A 128 VAL A 172 VAL^? 22.61 CL CL B 203 A 200 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 226 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 19.13 38.05 1.41 19.72 38.80 -0.53 24.59 39.97 -28.33 23.16 39.76 -26.69 coo 24.51 43.28 11.18 25.17 44.50 9.58 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 34.47 51.09 7.19 28.58 51.18 7.53 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1i29_c03 CSDB user 7 3 # 7 A 128 VAL A 172 VAL^? 22.61 CL CL B 203 A 200 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 226 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 19.13 38.05 1.41 19.72 38.80 -0.53 24.59 39.97 -28.33 23.16 39.76 -26.69 coo 24.51 43.28 11.18 25.17 44.50 9.58 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 34.47 51.09 7.19 28.58 51.18 7.53 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1i29_c03 CSDB user 8 3 # 8 A 128 VAL A 172 VAL^? 22.61 CL CL B 203 A 200 ASP A 158 ASP.? 28.53 CL CL B 203 A 226 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 19.13 38.05 1.41 19.72 38.80 -0.53 24.59 39.97 -28.33 23.16 39.76 -26.69 coo 24.51 43.28 11.18 25.17 44.50 9.58 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 34.47 51.09 7.19 28.58 51.18 7.53 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1i29_c03 CSDB user 9 3 # 9 A 128 VAL A 172 VAL^? 22.61 CL CL B 203 A 200 ASP A 165 ASP.? 13.91 CL CL B 203 A 226 LYS A 9 LYS^? 13.80 CL CL B 203 coo 19.13 38.05 1.41 19.72 38.80 -0.53 24.59 39.97 -28.33 23.16 39.76 -26.69 coo 24.51 43.28 11.18 25.17 44.50 9.58 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 34.47 51.09 7.19 28.58 51.18 7.53 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1i29_c03 CSDB user 10 3 # 10 A 128 VAL B 12 VAL^? 15.39 CL CL B 203 A 200 ASP A 24 ASP^? 8.56 CL CL B 203 A 226 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 19.13 38.05 1.41 19.72 38.80 -0.53 42.00 32.31 -10.43 42.27 30.23 -10.98 coo 24.51 43.28 11.18 25.17 44.50 9.58 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 34.47 51.09 7.19 28.58 51.18 7.53 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1i29_c03 CSDB user 11 3 # 11 A 128 VAL B 14 VAL^? 10.77 CL CL B 203 A 200 ASP B 165 ASP.? 24.35 CL CL B 203 A 226 LYS B 141 LYS~? 32.09 CL CL B 203 coo 19.13 38.05 1.41 19.72 38.80 -0.53 36.81 29.48 -13.07 37.94 27.58 -13.14 coo 24.51 43.28 11.18 25.17 44.50 9.58 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 34.47 51.09 7.19 28.58 51.18 7.53 50.65 30.91 -26.07 50.03 31.36 -31.64 ULMN 3 1i29_c03 CSDB user 12 3 # 12 A 128 VAL B 172 VAL^? 22.18 CL CL B 203 A 200 ASP B 165 ASP.? 24.35 CL CL B 203 A 226 LYS B 9 LYS^? 26.01 CL CL B 203 coo 19.13 38.05 1.41 19.72 38.80 -0.53 42.60 26.74 -25.56 44.07 26.79 -23.94 coo 24.51 43.28 11.18 25.17 44.50 9.58 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 34.47 51.09 7.19 28.58 51.18 7.53 50.82 33.22 -7.07 51.79 32.01 -1.71 1i29_c03 source 1i29 CSDB : 12 hits 1i29_c03 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 109 SER~? 36.36 CL CL B 203 A 173 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 211 ASP A 135 ASP~? 30.53 CL CL B 203 coo 22.72 76.24 0.23 24.60 76.86 -1.25 11.05 47.60 -32.89 11.53 46.95 -35.16 coo 18.77 77.82 11.69 20.55 80.22 10.73 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 16.71 44.39 -33.44 18.14 42.86 -33.63 1ig8_c00 source 1ig8 HEXOKINASE PII : 1 hits 1ig8_c00 naa= 3 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 # 1 54 ASP A 16 ASP^? 19.84 O2 SO4 A 201 158 THR A 155 THR^? 16.70 CL CL B 203 317 ASP A 24 ASP^? 8.56 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 33.21 43.75 -17.91 32.76 45.38 -19.21 coo -5.30 12.75 41.86 -4.34 13.05 39.99 32.10 37.97 -21.41 33.49 36.33 -21.72 coo -12.63 17.64 33.66 -10.65 17.90 34.40 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 2 3 # 2 54 ASP A 16 ASP^? 19.84 O2 SO4 A 201 158 THR A 155 THR^? 16.70 CL CL B 203 317 ASP B 165 ASP.? 24.35 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 33.21 43.75 -17.91 32.76 45.38 -19.21 coo -5.30 12.75 41.86 -4.34 13.05 39.99 32.10 37.97 -21.41 33.49 36.33 -21.72 coo -12.63 17.64 33.66 -10.65 17.90 34.40 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 3 3 # 3 54 ASP A 18 ASP.? 23.99 O2 SO4 A 201 158 THR A 155 THR^? 16.70 CL CL B 203 317 ASP B 165 ASP.? 24.35 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 35.31 47.04 -22.18 34.84 45.98 -23.97 coo -5.30 12.75 41.86 -4.34 13.05 39.99 32.10 37.97 -21.41 33.49 36.33 -21.72 coo -12.63 17.64 33.66 -10.65 17.90 34.40 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 # 4 54 ASP A 24 ASP^? 8.56 CL CL B 203 158 THR A 11 THR^? 4.56 CL CL B 203 317 ASP A 165 ASP.? 13.91 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -5.30 12.75 41.86 -4.34 13.05 39.99 24.05 32.29 -10.90 24.73 30.60 -9.78 coo -12.63 17.64 33.66 -10.65 17.90 34.40 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 5 3 # 5 54 ASP A 24 ASP^? 8.56 CL CL B 203 158 THR A 11 THR^? 4.56 CL CL B 203 317 ASP B 16 ASP^? 10.11 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -5.30 12.75 41.86 -4.34 13.05 39.99 24.05 32.29 -10.90 24.73 30.60 -9.78 coo -12.63 17.64 33.66 -10.65 17.90 34.40 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 6 3 # 6 54 ASP A 165 ASP.? 13.91 CL CL B 203 158 THR A 11 THR^? 4.56 CL CL B 203 317 ASP B 16 ASP^? 10.11 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 23.54 28.49 -20.46 22.55 27.96 -22.28 coo -5.30 12.75 41.86 -4.34 13.05 39.99 24.05 32.29 -10.90 24.73 30.60 -9.78 coo -12.63 17.64 33.66 -10.65 17.90 34.40 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 7 3 # 7 54 ASP B 16 ASP^? 10.11 CL CL B 203 158 THR B 155 THR^? 12.79 CL CL B 203 317 ASP A 24 ASP^? 8.56 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 33.53 24.74 -14.92 33.82 22.97 -16.03 coo -5.30 12.75 41.86 -4.34 13.05 39.99 35.45 29.84 -18.92 33.82 31.13 -19.55 coo -12.63 17.64 33.66 -10.65 17.90 34.40 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 8 3 # 8 54 ASP B 16 ASP^? 10.11 CL CL B 203 158 THR B 155 THR^? 12.79 CL CL B 203 317 ASP A 165 ASP.? 13.91 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 33.53 24.74 -14.92 33.82 22.97 -16.03 coo -5.30 12.75 41.86 -4.34 13.05 39.99 35.45 29.84 -18.92 33.82 31.13 -19.55 coo -12.63 17.64 33.66 -10.65 17.90 34.40 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 9 3 # 9 54 ASP B 16 ASP^? 10.11 CL CL B 203 158 THR B 155 THR^? 12.79 CL CL B 203 317 ASP B 24 ASP^? 11.11 CL CL B 203 coo -2.63 8.40 35.07 -3.66 9.81 36.17 33.53 24.74 -14.92 33.82 22.97 -16.03 coo -5.30 12.75 41.86 -4.34 13.05 39.99 35.45 29.84 -18.92 33.82 31.13 -19.55 coo -12.63 17.64 33.66 -10.65 17.90 34.40 37.06 32.38 -6.05 35.96 33.77 -7.20 1inp_c02 source 1inp INOSITOL POLYPHOSPHATE 1-PHOSPHATASE (1-PTASE): 9 hits 1inp_c02 naa= 3 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 1 3 # 1 A1132 ASP A 24 ASP^? 8.56 CL CL B 203 A1134 ALA B 15 ALA^? 9.07 CL CL B 203 A1137 ASN A 13 ASN^? 10.47 CL CL B 203 coo -27.05 34.58 17.12 -25.81 32.84 17.16 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -20.53 36.39 15.81 -20.80 35.01 16.40 33.44 29.49 -14.78 32.88 30.75 -15.46 coo -23.72 34.69 12.49 -24.32 32.83 13.34 30.72 33.91 -14.09 32.77 34.57 -14.11 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 2 3 # 2 A1132 ASP A 24 ASP^? 8.56 CL CL B 203 A1134 ALA B 15 ALA^? 9.07 CL CL B 203 A1137 ASN B 13 ASN^? 10.38 CL CL B 203 coo -27.05 34.58 17.12 -25.81 32.84 17.16 30.81 35.32 -8.62 32.08 34.13 -9.77 coo -20.53 36.39 15.81 -20.80 35.01 16.40 33.44 29.49 -14.78 32.88 30.75 -15.46 coo -23.72 34.69 12.49 -24.32 32.83 13.34 37.49 33.73 -11.31 35.37 33.37 -11.20 1ir3_c02 source 1ir3 INSULIN RECEPTOR : 2 hits 1ir3_c02 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 38 GLU~? 28.10 CL CL B 203 A 56 LYS A 141 LYS~? 27.34 CL CL B 203 A 258 ARG A 31 ARG^? 24.05 CL CL B 203 coo 42.33 1.56 26.99 42.38 2.91 28.66 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 38.45 -0.44 19.89 37.36 0.90 25.90 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 A 2 GLU A 38 GLU~? 28.10 CL CL B 203 A 56 LYS A 141 LYS~? 27.34 CL CL B 203 A 258 ARG A 43 ARG~? 21.16 CL CL B 203 coo 42.33 1.56 26.99 42.38 2.91 28.66 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 38.45 -0.44 19.89 37.36 0.90 25.90 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 A 2 GLU A 89 GLU~? 32.07 O4 SO4 A 201 A 56 LYS A 122 LYS~? 33.55 O4 SO4 A 201 A 258 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo 42.33 1.56 26.99 42.38 2.91 28.66 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 38.45 -0.44 19.89 37.36 0.90 25.90 14.46 65.90 -26.67 9.45 67.99 -27.93 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 9.44 57.19 -15.50 10.34 55.43 -13.15 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 A 2 GLU B 38 GLU~? 33.41 CL CL B 203 A 56 LYS B 141 LYS~? 32.09 CL CL B 203 A 258 ARG B 31 ARG^? 34.85 CL CL B 203 coo 42.33 1.56 26.99 42.38 2.91 28.66 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 38.45 -0.44 19.89 37.36 0.90 25.90 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 59.17 28.21 -12.86 61.91 28.73 -14.07 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 A 2 GLU B 38 GLU~? 33.41 CL CL B 203 A 56 LYS B 141 LYS~? 32.09 CL CL B 203 A 258 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo 42.33 1.56 26.99 42.38 2.91 28.66 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 38.45 -0.44 19.89 37.36 0.90 25.90 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 A 2 GLU B 38 GLU~? 33.41 CL CL B 203 A 56 LYS B 141 LYS~? 32.09 CL CL B 203 A 258 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 42.33 1.56 26.99 42.38 2.91 28.66 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 38.45 -0.44 19.89 37.36 0.90 25.90 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 A 2 GLU B 137 GLU~? 34.50 CL CL B 203 A 56 LYS B 141 LYS~? 32.09 CL CL B 203 A 258 ARG B 110 ARG~? 44.21 CL CL B 203 coo 42.33 1.56 26.99 42.38 2.91 28.66 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 38.45 -0.44 19.89 37.36 0.90 25.90 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 60.95 18.14 -32.42 62.40 18.76 -35.07 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 7 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 38 GLU~? 28.10 CL CL B 203 B 56 LYS A 141 LYS~? 27.34 CL CL B 203 B 258 ARG A 31 ARG^? 24.05 CL CL B 203 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 2.64 1.83 34.81 1.56 1.13 32.02 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 B 2 GLU A 38 GLU~? 28.10 CL CL B 203 B 56 LYS A 141 LYS~? 27.34 CL CL B 203 B 258 ARG A 43 ARG~? 21.16 CL CL B 203 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 2.64 1.83 34.81 1.56 1.13 32.02 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 B 2 GLU A 89 GLU~? 32.07 O4 SO4 A 201 B 56 LYS A 122 LYS~? 33.55 O4 SO4 A 201 B 258 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 14.46 65.90 -26.67 9.45 67.99 -27.93 coo 2.64 1.83 34.81 1.56 1.13 32.02 9.44 57.19 -15.50 10.34 55.43 -13.15 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 B 2 GLU B 38 GLU~? 33.41 CL CL B 203 B 56 LYS B 141 LYS~? 32.09 CL CL B 203 B 258 ARG B 31 ARG^? 34.85 CL CL B 203 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 2.64 1.83 34.81 1.56 1.13 32.02 59.17 28.21 -12.86 61.91 28.73 -14.07 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 B 2 GLU B 38 GLU~? 33.41 CL CL B 203 B 56 LYS B 141 LYS~? 32.09 CL CL B 203 B 258 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 2.64 1.83 34.81 1.56 1.13 32.02 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 B 2 GLU B 38 GLU~? 33.41 CL CL B 203 B 56 LYS B 141 LYS~? 32.09 CL CL B 203 B 258 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 2.64 1.83 34.81 1.56 1.13 32.02 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 B 2 GLU B 137 GLU~? 34.50 CL CL B 203 B 56 LYS B 141 LYS~? 32.09 CL CL B 203 B 258 ARG B 110 ARG~? 44.21 CL CL B 203 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 2.64 1.83 34.81 1.56 1.13 32.02 60.95 18.14 -32.42 62.40 18.76 -35.07 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 7 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 38 GLU~? 28.10 CL CL B 203 C 56 LYS A 141 LYS~? 27.34 CL CL B 203 C 258 ARG A 31 ARG^? 24.05 CL CL B 203 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 C 2 GLU A 38 GLU~? 28.10 CL CL B 203 C 56 LYS A 141 LYS~? 27.34 CL CL B 203 C 258 ARG A 43 ARG~? 21.16 CL CL B 203 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 C 2 GLU A 89 GLU~? 32.07 O4 SO4 A 201 C 56 LYS A 122 LYS~? 33.55 O4 SO4 A 201 C 258 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 14.46 65.90 -26.67 9.45 67.99 -27.93 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 9.44 57.19 -15.50 10.34 55.43 -13.15 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 C 2 GLU B 38 GLU~? 33.41 CL CL B 203 C 56 LYS B 141 LYS~? 32.09 CL CL B 203 C 258 ARG B 31 ARG^? 34.85 CL CL B 203 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 59.17 28.21 -12.86 61.91 28.73 -14.07 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 C 2 GLU B 38 GLU~? 33.41 CL CL B 203 C 56 LYS B 141 LYS~? 32.09 CL CL B 203 C 258 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 C 2 GLU B 38 GLU~? 33.41 CL CL B 203 C 56 LYS B 141 LYS~? 32.09 CL CL B 203 C 258 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 C 2 GLU B 137 GLU~? 34.50 CL CL B 203 C 56 LYS B 141 LYS~? 32.09 CL CL B 203 C 258 ARG B 110 ARG~? 44.21 CL CL B 203 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 60.95 18.14 -32.42 62.40 18.76 -35.07 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 7 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 38 GLU~? 28.10 CL CL B 203 D 56 LYS A 141 LYS~? 27.34 CL CL B 203 D 258 ARG A 31 ARG^? 24.05 CL CL B 203 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 D 2 GLU A 38 GLU~? 28.10 CL CL B 203 D 56 LYS A 141 LYS~? 27.34 CL CL B 203 D 258 ARG A 43 ARG~? 21.16 CL CL B 203 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 D 2 GLU A 89 GLU~? 32.07 O4 SO4 A 201 D 56 LYS A 122 LYS~? 33.55 O4 SO4 A 201 D 258 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 14.46 65.90 -26.67 9.45 67.99 -27.93 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 9.44 57.19 -15.50 10.34 55.43 -13.15 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 D 2 GLU B 38 GLU~? 33.41 CL CL B 203 D 56 LYS B 141 LYS~? 32.09 CL CL B 203 D 258 ARG B 31 ARG^? 34.85 CL CL B 203 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 59.17 28.21 -12.86 61.91 28.73 -14.07 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 D 2 GLU B 38 GLU~? 33.41 CL CL B 203 D 56 LYS B 141 LYS~? 32.09 CL CL B 203 D 258 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 57.17 19.82 -16.25 56.33 16.88 -15.94 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 D 2 GLU B 38 GLU~? 33.41 CL CL B 203 D 56 LYS B 141 LYS~? 32.09 CL CL B 203 D 258 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 D 2 GLU B 137 GLU~? 34.50 CL CL B 203 D 56 LYS B 141 LYS~? 32.09 CL CL B 203 D 258 ARG B 110 ARG~? 44.21 CL CL B 203 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 60.95 18.14 -32.42 62.40 18.76 -35.07 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 7 hits 1k82_c03 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 35 GLU.? 23.66 CL CL B 203 A 163 ARG A 31 ARG^? 24.05 CL CL B 203 A 222 ARG A 43 ARG~? 21.16 CL CL B 203 coo 51.27 81.34 48.31 51.67 80.79 50.28 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 48.06 78.22 50.94 48.51 78.27 53.98 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 54.85 84.16 52.60 54.26 81.23 53.34 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU A 35 GLU.? 23.66 CL CL B 203 A 163 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 222 ARG A 31 ARG^? 24.05 CL CL B 203 coo 51.27 81.34 48.31 51.67 80.79 50.28 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 48.06 78.22 50.94 48.51 78.27 53.98 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 54.85 84.16 52.60 54.26 81.23 53.34 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1kim_c00 THYMIDINE KINASE user 3 3 # 3 A 83 GLU A 35 GLU.? 23.66 CL CL B 203 A 163 ARG A 43 ARG~? 21.16 CL CL B 203 A 222 ARG A 31 ARG^? 24.05 CL CL B 203 coo 51.27 81.34 48.31 51.67 80.79 50.28 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 48.06 78.22 50.94 48.51 78.27 53.98 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 54.85 84.16 52.60 54.26 81.23 53.34 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1kim_c00 THYMIDINE KINASE user 4 3 # 4 A 83 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 163 ARG B 31 ARG^? 34.85 CL CL B 203 A 222 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 51.27 81.34 48.31 51.67 80.79 50.28 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 48.06 78.22 50.94 48.51 78.27 53.98 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 54.85 84.16 52.60 54.26 81.23 53.34 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1kim_c00 THYMIDINE KINASE user 5 3 # 5 A 83 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 163 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 222 ARG B 31 ARG^? 34.85 CL CL B 203 coo 51.27 81.34 48.31 51.67 80.79 50.28 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 48.06 78.22 50.94 48.51 78.27 53.98 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 54.85 84.16 52.60 54.26 81.23 53.34 59.17 28.21 -12.86 61.91 28.73 -14.07 ULMN 3 1kim_c00 THYMIDINE KINASE user 6 3 # 6 A 83 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 163 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 222 ARG B 31 ARG^? 34.85 CL CL B 203 coo 51.27 81.34 48.31 51.67 80.79 50.28 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 48.06 78.22 50.94 48.51 78.27 53.98 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 54.85 84.16 52.60 54.26 81.23 53.34 59.17 28.21 -12.86 61.91 28.73 -14.07 1kim_c00 source 1kim THYMIDINE KINASE : 6 hits 1kim_c00 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 65 ASP.? 22.23 O3 SO4 A 201 262 LYS A 94 LYS~? 22.47 O3 SO4 A 201 336 ARG A 72 ARG^? 12.89 O3 SO4 A 201 coo 61.88 50.78 12.96 63.84 50.60 13.71 7.01 55.74 -9.90 7.72 56.49 -8.05 coo 63.59 44.40 18.32 63.20 49.74 17.95 12.51 62.07 -13.42 8.27 61.24 -10.02 coo 72.60 57.42 15.86 71.61 56.68 18.70 19.61 53.07 -4.13 17.97 51.61 -1.95 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP A 136 ASP~? 33.35 CL CL B 203 262 LYS A 141 LYS~? 27.34 CL CL B 203 336 ARG A 39 ARG~? 27.60 O2 SO4 A 201 coo 61.88 50.78 12.96 63.84 50.60 13.71 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 63.59 44.40 18.32 63.20 49.74 17.95 17.29 34.80 -28.79 19.89 34.33 -34.52 coo 72.60 57.42 15.86 71.61 56.68 18.70 9.26 44.73 -19.12 9.60 47.81 -19.09 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 3 3 # 3 255 ASP B 65 ASP.? 21.45 O1 SO4 B 202 262 LYS B 94 LYS~? 21.71 O1 SO4 B 202 336 ARG B 72 ARG^? 12.97 O1 SO4 B 202 coo 61.88 50.78 12.96 63.84 50.60 13.71 57.62 9.59 -5.23 56.36 8.07 -4.49 coo 63.59 44.40 18.32 63.20 49.74 17.95 51.38 3.18 -10.50 55.68 5.47 -6.55 coo 72.60 57.42 15.86 71.61 56.68 18.70 45.42 12.48 -0.13 47.39 14.66 0.83 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 4 3 # 4 255 ASP B 136 ASP~? 35.38 CL CL B 203 262 LYS B 141 LYS~? 32.09 CL CL B 203 336 ARG B 39 ARG~? 27.56 O4 SO4 B 202 coo 61.88 50.78 12.96 63.84 50.60 13.71 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 63.59 44.40 18.32 63.20 49.74 17.95 50.65 30.91 -26.07 50.03 31.36 -31.64 coo 72.60 57.42 15.86 71.61 56.68 18.70 57.17 19.82 -16.25 56.33 16.88 -15.94 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 4 hits 1lam_c00 naa= 3 ULMN 3 1lci_c00 LUCIFERASE user 1 3 # 1 218 ARG A 43 ARG~? 21.16 CL CL B 203 245 HIS A 32 HIS.? 29.45 CL CL B 203 343 THR A 6 THR^? 21.60 CL CL B 203 coo 18.11 85.25 41.19 18.04 83.33 43.59 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 5.34 86.23 43.48 6.16 87.26 45.12 3.09 41.50 -11.72 1.06 42.02 -11.62 coo 9.06 92.76 42.80 7.04 92.63 42.14 7.29 33.91 -10.43 6.77 32.60 -12.09 ULMN 3 1lci_c00 LUCIFERASE user 2 3 # 2 218 ARG B 43 ARG~? 25.25 O4 SO4 B 202 245 HIS B 32 HIS.? 32.94 O4 SO4 B 202 343 THR B 6 THR^? 34.20 CL CL B 203 coo 18.11 85.25 41.19 18.04 83.33 43.59 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 5.34 86.23 43.48 6.16 87.26 45.12 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 9.06 92.76 42.80 7.04 92.63 42.14 60.64 30.49 -7.49 61.30 31.70 -9.15 1lci_c00 source 1lci LUCIFERASE : 2 hits 1lci_c00 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 265 GLU B 171 GLU^? 23.59 CL CL B 203 A 369 ASP A 158 ASP.? 28.53 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 17.36 23.57 72.04 18.68 21.92 71.98 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 35.14 45.22 -28.92 37.28 45.17 -28.91 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 265 GLU B 171 GLU^? 23.59 CL CL B 203 A 369 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 17.36 23.57 72.04 18.68 21.92 71.98 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 265 GLU A 53 GLU.? 13.05 O2 SO4 A 201 A 369 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 17.36 23.57 72.04 18.68 21.92 71.98 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 12.19 31.08 87.29 11.13 32.66 86.38 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 265 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 369 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 17.36 23.57 72.04 18.68 21.92 71.98 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 12.19 31.08 87.29 11.13 32.66 86.38 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 265 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 369 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 17.36 23.57 72.04 18.68 21.92 71.98 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 12.19 31.08 87.29 11.13 32.66 86.38 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 6 3 # 6 A 241 ASP A 158 ASP.? 28.53 CL CL B 203 A 265 GLU B 171 GLU^? 23.59 CL CL B 203 A 369 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 17.36 23.57 72.04 18.68 21.92 71.98 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 7 3 # 7 A 241 ASP A 166 ASP.? 11.63 CL CL B 203 A 265 GLU A 171 GLU^? 26.34 CL CL B 203 A 369 ASP B 158 ASP.? 18.10 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 17.36 23.57 72.04 18.68 21.92 71.98 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 12.19 31.08 87.29 11.13 32.66 86.38 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 8 3 # 8 A 241 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 265 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 369 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 11.74 38.14 80.19 10.63 36.40 80.65 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 17.36 23.57 72.04 18.68 21.92 71.98 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 12.19 31.08 87.29 11.13 32.66 86.38 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 9 3 # 9 A 241 ASP B 158 ASP.? 18.10 CL CL B 203 A 265 GLU A 171 GLU^? 26.34 CL CL B 203 A 369 ASP A 166 ASP.? 11.63 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 17.36 23.57 72.04 18.68 21.92 71.98 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 12.19 31.08 87.29 11.13 32.66 86.38 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 10 3 # 10 A 241 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 265 GLU A 53 GLU.? 13.05 O2 SO4 A 201 A 369 ASP A 18 ASP.? 23.99 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 17.36 23.57 72.04 18.68 21.92 71.98 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 12.19 31.08 87.29 11.13 32.66 86.38 35.31 47.04 -22.18 34.84 45.98 -23.97 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 11 3 # 11 A 241 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 265 GLU B 171 GLU^? 23.59 CL CL B 203 A 369 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 17.36 23.57 72.04 18.68 21.92 71.98 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 12 3 # 12 A 241 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 265 GLU B 171 GLU^? 23.59 CL CL B 203 A 369 ASP A 18 ASP.? 23.99 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 17.36 23.57 72.04 18.68 21.92 71.98 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 35.31 47.04 -22.18 34.84 45.98 -23.97 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 12 hits 1m53_c05 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 279 GLU B 171 GLU^? 23.59 CL CL B 203 A 369 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 16.54 46.37 63.94 14.77 45.79 62.95 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 279 GLU A 66 GLU.? 18.87 O3 SO4 A 201 A 369 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 16.54 46.37 63.94 14.77 45.79 62.95 10.83 52.69 -6.96 11.60 51.77 -5.23 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP A 147 ASP.? 14.36 CL CL B 203 A 279 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 369 ASP A 166 ASP.? 11.63 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 16.54 46.37 63.94 14.77 45.79 62.95 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 12.19 31.08 87.29 11.13 32.66 86.38 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP A 165 ASP.? 13.91 CL CL B 203 A 279 GLU A 38 GLU~? 28.10 CL CL B 203 A 369 ASP B 18 ASP.? 13.73 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 16.54 46.37 63.94 14.77 45.79 62.95 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 12.19 31.08 87.29 11.13 32.66 86.38 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP A 165 ASP.? 13.91 CL CL B 203 A 279 GLU A 38 GLU~? 28.10 CL CL B 203 A 369 ASP B 158 ASP.? 18.10 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 16.54 46.37 63.94 14.77 45.79 62.95 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 12.19 31.08 87.29 11.13 32.66 86.38 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 6 3 # 6 A 241 ASP A 165 ASP.? 13.91 CL CL B 203 A 279 GLU A 137 GLU~? 32.46 CL CL B 203 A 369 ASP B 18 ASP.? 13.73 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 16.54 46.37 63.94 14.77 45.79 62.95 15.44 38.60 -35.89 16.74 38.72 -37.58 coo 12.19 31.08 87.29 11.13 32.66 86.38 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 7 3 # 7 A 241 ASP A 166 ASP.? 11.63 CL CL B 203 A 279 GLU B 101 GLU^? 13.49 O2 SO4 B 202 A 369 ASP A 147 ASP.? 14.36 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 16.54 46.37 63.94 14.77 45.79 62.95 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 12.19 31.08 87.29 11.13 32.66 86.38 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 8 3 # 8 A 241 ASP B 16 ASP^? 10.11 CL CL B 203 A 279 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 369 ASP A 166 ASP.? 11.63 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 16.54 46.37 63.94 14.77 45.79 62.95 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 12.19 31.08 87.29 11.13 32.66 86.38 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 9 3 # 9 A 241 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 279 GLU B 66 GLU.? 19.61 O1 SO4 B 202 A 369 ASP B 16 ASP^? 10.11 CL CL B 203 coo 11.74 38.14 80.19 10.63 36.40 80.65 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 16.54 46.37 63.94 14.77 45.79 62.95 54.16 12.70 -3.87 54.28 14.29 -2.42 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.53 24.74 -14.92 33.82 22.97 -16.03 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 9 hits 1m53_c06 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 31 ARG^? 24.05 CL CL B 203 229 SER A 34 SER.? 29.93 CL CL B 203 325 GLU A 35 GLU.? 23.66 CL CL B 203 coo 2.54 15.84 18.57 3.24 17.85 16.30 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 10.17 13.48 15.92 9.61 15.76 15.27 2.32 41.65 -16.48 3.04 43.36 -14.94 coo 5.42 13.04 19.75 5.74 13.81 17.79 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 2 3 # 2 159 ARG A 39 ARG~? 27.60 O2 SO4 A 201 229 SER A 34 SER.? 29.93 CL CL B 203 325 GLU A 35 GLU.? 23.66 CL CL B 203 coo 2.54 15.84 18.57 3.24 17.85 16.30 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 10.17 13.48 15.92 9.61 15.76 15.27 2.32 41.65 -16.48 3.04 43.36 -14.94 coo 5.42 13.04 19.75 5.74 13.81 17.79 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 3 3 # 3 159 ARG B 31 ARG^? 34.85 CL CL B 203 229 SER B 34 SER.? 32.42 O4 SO4 B 202 325 GLU B 35 GLU.? 28.14 O4 SO4 B 202 coo 2.54 15.84 18.57 3.24 17.85 16.30 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 10.17 13.48 15.92 9.61 15.76 15.27 64.42 22.00 -13.52 63.28 20.51 -12.03 coo 5.42 13.04 19.75 5.74 13.81 17.79 58.35 23.06 -14.04 56.92 23.13 -12.46 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 4 3 # 4 159 ARG B 39 ARG~? 27.56 O4 SO4 B 202 229 SER B 34 SER.? 32.42 O4 SO4 B 202 325 GLU B 35 GLU.? 28.14 O4 SO4 B 202 coo 2.54 15.84 18.57 3.24 17.85 16.30 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 10.17 13.48 15.92 9.61 15.76 15.27 64.42 22.00 -13.52 63.28 20.51 -12.03 coo 5.42 13.04 19.75 5.74 13.81 17.79 58.35 23.06 -14.04 56.92 23.13 -12.46 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 4 hits 1mbb_c00 naa= 3 ULMN 3 1myr_c00 MYROSINASE user 1 3 # 1 187 GLN A 138 GLN~? 27.25 CL CL B 203 328 ASN A 173 ASN.? 27.41 CL CL B 203 409 GLU A 171 GLU^? 26.34 CL CL B 203 coo 45.09 114.33 52.30 45.59 116.18 51.29 20.25 40.28 -31.71 21.70 41.77 -31.43 coo 41.10 116.46 52.80 42.09 116.00 54.64 25.34 43.35 -31.46 27.19 42.45 -31.89 coo 42.69 118.64 56.27 44.58 118.34 55.45 28.18 38.40 -30.98 29.16 38.58 -32.86 ULMN 3 1myr_c00 MYROSINASE user 2 3 # 2 187 GLN B 138 GLN~? 26.29 CL CL B 203 328 ASN B 173 ASN^? 23.36 CL CL B 203 409 GLU B 171 GLU^? 23.59 CL CL B 203 coo 45.09 114.33 52.30 45.59 116.18 51.29 46.91 25.45 -29.10 45.06 24.53 -28.64 coo 41.10 116.46 52.80 42.09 116.00 54.64 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 42.69 118.64 56.27 44.58 118.34 55.45 39.63 28.73 -28.22 38.55 28.71 -30.01 1myr_c00 source 1myr MYROSINASE : 2 hits 1myr_c00 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 19 ARG.? 15.12 O2 SO4 A 201 A 101 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 132 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 11.61 22.83 17.30 14.06 21.71 15.78 32.30 48.48 -17.38 30.29 47.61 -15.22 coo 11.37 24.94 11.48 12.48 24.45 13.28 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 16.14 18.17 13.37 15.92 19.81 14.71 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 A 101 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.61 22.83 17.30 14.06 21.71 15.78 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.37 24.94 11.48 12.48 24.45 13.28 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 16.14 18.17 13.37 15.92 19.81 14.71 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 A 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 A 101 ASP A 74 ASP.? -4.21 O2 SO4 A 201s A 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.61 22.83 17.30 14.06 21.71 15.78 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.37 24.94 11.48 12.48 24.45 13.28 29.24 55.36 0.45 30.25 53.50 0.45 coo 16.14 18.17 13.37 15.92 19.81 14.71 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 A 99 ARG B 19 ARG.? 10.93 CL CL B 203 A 101 ASP B 16 ASP^? 10.11 CL CL B 203 A 132 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 11.61 22.83 17.30 14.06 21.71 15.78 34.18 19.86 -14.65 35.93 20.77 -12.27 coo 11.37 24.94 11.48 12.48 24.45 13.28 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 16.14 18.17 13.37 15.92 19.81 14.71 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 A 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 A 101 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.61 22.83 17.30 14.06 21.71 15.78 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.37 24.94 11.48 12.48 24.45 13.28 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 16.14 18.17 13.37 15.92 19.81 14.71 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 A 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 A 101 ASP B 74 ASP.? -3.98 O4 SO4 B 202s A 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.61 22.83 17.30 14.06 21.71 15.78 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.37 24.94 11.48 12.48 24.45 13.28 35.83 12.25 3.35 35.06 14.20 3.07 coo 16.14 18.17 13.37 15.92 19.81 14.71 39.00 11.56 -6.02 37.46 10.80 -4.75 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 19 ARG.? 15.12 O2 SO4 A 201 B 101 ASP A 16 ASP^? 19.84 O2 SO4 A 201 B 132 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 11.61 3.43 18.38 9.11 4.29 16.86 32.30 48.48 -17.38 30.29 47.61 -15.22 coo 11.74 0.51 12.98 10.75 1.32 14.67 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 6.93 7.52 14.08 7.18 6.08 15.65 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 B 101 ASP A 52 ASP.? 10.10 O2 SO4 A 201 B 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.61 3.43 18.38 9.11 4.29 16.86 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.74 0.51 12.98 10.75 1.32 14.67 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 6.93 7.52 14.08 7.18 6.08 15.65 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 B 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 B 101 ASP A 74 ASP.? -4.21 O2 SO4 A 201s B 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.61 3.43 18.38 9.11 4.29 16.86 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.74 0.51 12.98 10.75 1.32 14.67 29.24 55.36 0.45 30.25 53.50 0.45 coo 6.93 7.52 14.08 7.18 6.08 15.65 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 B 99 ARG B 19 ARG.? 10.93 CL CL B 203 B 101 ASP B 16 ASP^? 10.11 CL CL B 203 B 132 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 11.61 3.43 18.38 9.11 4.29 16.86 34.18 19.86 -14.65 35.93 20.77 -12.27 coo 11.74 0.51 12.98 10.75 1.32 14.67 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 6.93 7.52 14.08 7.18 6.08 15.65 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 B 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 B 101 ASP B 52 ASP.? 10.23 O4 SO4 B 202 B 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.61 3.43 18.38 9.11 4.29 16.86 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.74 0.51 12.98 10.75 1.32 14.67 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 6.93 7.52 14.08 7.18 6.08 15.65 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 B 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 B 101 ASP B 74 ASP.? -3.98 O4 SO4 B 202s B 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.61 3.43 18.38 9.11 4.29 16.86 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.74 0.51 12.98 10.75 1.32 14.67 35.83 12.25 3.35 35.06 14.20 3.07 coo 6.93 7.52 14.08 7.18 6.08 15.65 39.00 11.56 -6.02 37.46 10.80 -4.75 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 19 ARG.? 15.12 O2 SO4 A 201 A 101 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 132 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 11.50 22.77 17.24 14.00 21.62 15.86 32.30 48.48 -17.38 30.29 47.61 -15.22 coo 11.19 25.00 11.76 12.16 24.45 13.59 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 16.04 18.11 13.43 15.88 19.70 14.83 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 A 101 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.50 22.77 17.24 14.00 21.62 15.86 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.19 25.00 11.76 12.16 24.45 13.59 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 16.04 18.11 13.43 15.88 19.70 14.83 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 A 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 A 101 ASP A 74 ASP.? -4.21 O2 SO4 A 201s A 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.50 22.77 17.24 14.00 21.62 15.86 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.19 25.00 11.76 12.16 24.45 13.59 29.24 55.36 0.45 30.25 53.50 0.45 coo 16.04 18.11 13.43 15.88 19.70 14.83 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 A 99 ARG B 19 ARG.? 10.93 CL CL B 203 A 101 ASP B 16 ASP^? 10.11 CL CL B 203 A 132 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 11.50 22.77 17.24 14.00 21.62 15.86 34.18 19.86 -14.65 35.93 20.77 -12.27 coo 11.19 25.00 11.76 12.16 24.45 13.59 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 16.04 18.11 13.43 15.88 19.70 14.83 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 A 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 A 101 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.50 22.77 17.24 14.00 21.62 15.86 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.19 25.00 11.76 12.16 24.45 13.59 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 16.04 18.11 13.43 15.88 19.70 14.83 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 A 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 A 101 ASP B 74 ASP.? -3.98 O4 SO4 B 202s A 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.50 22.77 17.24 14.00 21.62 15.86 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.19 25.00 11.76 12.16 24.45 13.59 35.83 12.25 3.35 35.06 14.20 3.07 coo 16.04 18.11 13.43 15.88 19.70 14.83 39.00 11.56 -6.02 37.46 10.80 -4.75 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 19 ARG.? 15.12 O2 SO4 A 201 B 101 ASP A 16 ASP^? 19.84 O2 SO4 A 201 B 132 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 11.48 3.09 18.25 9.01 4.07 16.77 32.30 48.48 -17.38 30.29 47.61 -15.22 coo 11.83 0.33 13.01 10.88 1.04 14.81 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 6.85 7.33 14.07 7.10 5.88 15.60 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 B 101 ASP A 52 ASP.? 10.10 O2 SO4 A 201 B 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.48 3.09 18.25 9.01 4.07 16.77 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.83 0.33 13.01 10.88 1.04 14.81 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 6.85 7.33 14.07 7.10 5.88 15.60 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 B 99 ARG A 54 ARG.? 5.15 O2 SO4 A 201 B 101 ASP A 74 ASP.? -4.21 O2 SO4 A 201s B 132 ASP A 79 ASP^? 5.34 O4 SO4 A 201 coo 11.48 3.09 18.25 9.01 4.07 16.77 28.38 49.28 -3.97 28.82 51.36 -1.74 coo 11.83 0.33 13.01 10.88 1.04 14.81 29.24 55.36 0.45 30.25 53.50 0.45 coo 6.85 7.33 14.07 7.10 5.88 15.60 26.05 55.51 -8.88 27.40 56.46 -7.54 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 B 99 ARG B 19 ARG.? 10.93 CL CL B 203 B 101 ASP B 16 ASP^? 10.11 CL CL B 203 B 132 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 11.48 3.09 18.25 9.01 4.07 16.77 34.18 19.86 -14.65 35.93 20.77 -12.27 coo 11.83 0.33 13.01 10.88 1.04 14.81 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 6.85 7.33 14.07 7.10 5.88 15.60 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 B 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 B 101 ASP B 52 ASP.? 10.23 O4 SO4 B 202 B 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.48 3.09 18.25 9.01 4.07 16.77 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.83 0.33 13.01 10.88 1.04 14.81 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 6.85 7.33 14.07 7.10 5.88 15.60 39.00 11.56 -6.02 37.46 10.80 -4.75 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 B 99 ARG B 54 ARG.? 5.08 O4 SO4 B 202 B 101 ASP B 74 ASP.? -3.98 O4 SO4 B 202s B 132 ASP B 79 ASP^? 5.64 O2 SO4 B 202 coo 11.48 3.09 18.25 9.01 4.07 16.77 37.77 18.62 -0.73 37.02 15.96 0.60 coo 11.83 0.33 13.01 10.88 1.04 14.81 35.83 12.25 3.35 35.06 14.20 3.07 coo 6.85 7.33 14.07 7.10 5.88 15.60 39.00 11.56 -6.02 37.46 10.80 -4.75 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nww_c03 naa= 3 ULMN 3 1ofd_c02 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 1 3 # 1 A 1 CYH A 96 CYH~? 19.25 O4 SO4 A 201 A 903 GLU A 171 GLU^? 26.34 CL CL B 203 A 972 LYS A 141 LYS~? 27.34 CL CL B 203 coo 88.42 112.53 24.94 87.72 110.88 27.11 17.99 61.88 -15.34 18.02 61.29 -18.00 coo 61.58 117.15 13.99 62.31 115.51 15.12 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 60.18 107.64 21.53 58.13 110.55 17.14 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1ofd_c02 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 2 3 # 2 A 1 CYH A 123 CYH~? 26.41 O4 SO4 A 201 A 903 GLU A 171 GLU^? 26.34 CL CL B 203 A 972 LYS A 141 LYS~? 27.34 CL CL B 203 coo 88.42 112.53 24.94 87.72 110.88 27.11 16.65 63.11 -25.17 15.14 60.77 -25.01 coo 61.58 117.15 13.99 62.31 115.51 15.12 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 60.18 107.64 21.53 58.13 110.55 17.14 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1ofd_c02 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 3 3 # 3 A 1 CYH B 96 CYH~? 19.61 O1 SO4 B 202 A 903 GLU B 171 GLU^? 23.59 CL CL B 203 A 972 LYS B 141 LYS~? 32.09 CL CL B 203 coo 88.42 112.53 24.94 87.72 110.88 27.11 46.07 4.30 -12.39 46.23 4.84 -15.13 coo 61.58 117.15 13.99 62.31 115.51 15.12 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 60.18 107.64 21.53 58.13 110.55 17.14 50.65 30.91 -26.07 50.03 31.36 -31.64 ULMN 3 1ofd_c02 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 4 3 # 4 A 1 CYH B 123 CYH~? 26.91 O2 SO4 B 202 A 903 GLU B 171 GLU^? 23.59 CL CL B 203 A 972 LYS B 141 LYS~? 32.09 CL CL B 203 coo 88.42 112.53 24.94 87.72 110.88 27.11 47.23 3.07 -22.15 49.04 5.20 -22.47 coo 61.58 117.15 13.99 62.31 115.51 15.12 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 60.18 107.64 21.53 58.13 110.55 17.14 50.65 30.91 -26.07 50.03 31.36 -31.64 1ofd_c02 source 1ofd FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE 2 : 4 hits 1ofd_c02 naa= 3 ULMN 3 1ofd_c03 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 1 3 # 1 B 1 CYH A 96 CYH~? 19.25 O4 SO4 A 201 B 903 GLU A 171 GLU^? 26.34 CL CL B 203 B 972 LYS A 141 LYS~? 27.34 CL CL B 203 coo 31.47 38.87 24.90 30.94 36.98 26.93 17.99 61.88 -15.34 18.02 61.29 -18.00 coo 4.13 40.53 14.21 5.06 38.89 15.19 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 4.08 30.40 21.12 1.62 33.28 16.83 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1ofd_c03 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 2 3 # 2 B 1 CYH A 123 CYH~? 26.41 O4 SO4 A 201 B 903 GLU A 171 GLU^? 26.34 CL CL B 203 B 972 LYS A 141 LYS~? 27.34 CL CL B 203 coo 31.47 38.87 24.90 30.94 36.98 26.93 16.65 63.11 -25.17 15.14 60.77 -25.01 coo 4.13 40.53 14.21 5.06 38.89 15.19 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 4.08 30.40 21.12 1.62 33.28 16.83 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1ofd_c03 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 3 3 # 3 B 1 CYH B 96 CYH~? 19.61 O1 SO4 B 202 B 903 GLU B 171 GLU^? 23.59 CL CL B 203 B 972 LYS B 141 LYS~? 32.09 CL CL B 203 coo 31.47 38.87 24.90 30.94 36.98 26.93 46.07 4.30 -12.39 46.23 4.84 -15.13 coo 4.13 40.53 14.21 5.06 38.89 15.19 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 4.08 30.40 21.12 1.62 33.28 16.83 50.65 30.91 -26.07 50.03 31.36 -31.64 ULMN 3 1ofd_c03 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 4 3 # 4 B 1 CYH B 123 CYH~? 26.91 O2 SO4 B 202 B 903 GLU B 171 GLU^? 23.59 CL CL B 203 B 972 LYS B 141 LYS~? 32.09 CL CL B 203 coo 31.47 38.87 24.90 30.94 36.98 26.93 47.23 3.07 -22.15 49.04 5.20 -22.47 coo 4.13 40.53 14.21 5.06 38.89 15.19 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 4.08 30.40 21.12 1.62 33.28 16.83 50.65 30.91 -26.07 50.03 31.36 -31.64 1ofd_c03 source 1ofd FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE 2 : 4 hits 1ofd_c03 naa= 3 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 B 175 LYS A 94 LYS~? 22.47 O3 SO4 A 201 B 208 GLN A 125 GLN.? 25.97 O4 SO4 A 201 B 209 LYS A 122 LYS~? 33.55 O4 SO4 A 201 coo 105.03 46.01 19.55 106.59 42.35 15.55 12.51 62.07 -13.42 8.27 61.24 -10.02 coo 113.93 46.99 13.56 113.37 48.52 14.95 17.14 68.47 -22.10 15.05 68.83 -21.71 coo 115.66 49.12 8.60 111.19 49.52 4.73 14.46 65.90 -26.67 9.45 67.99 -27.93 1ohh_c07 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 1 hits 1ohh_c07 naa= 3 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 C 175 LYS A 94 LYS~? 22.47 O3 SO4 A 201 C 208 GLN A 125 GLN.? 25.97 O4 SO4 A 201 C 209 LYS A 122 LYS~? 33.55 O4 SO4 A 201 coo 100.54 -2.78 25.52 103.29 2.02 24.05 12.51 62.07 -13.42 8.27 61.24 -10.02 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 17.14 68.47 -22.10 15.05 68.83 -21.71 coo 113.62 1.19 33.65 109.52 3.92 36.47 14.46 65.90 -26.67 9.45 67.99 -27.93 1ohh_c08 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 1 hits 1ohh_c08 naa= 3 ULMN 3 1p1x_c00 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 1 3 # 1 A 102 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 167 LYS B 93 LYS~? 24.54 O1 SO4 B 202 A 201 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo 26.53 8.31 20.37 28.45 8.41 19.40 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 24.92 6.08 13.38 27.75 4.33 18.83 50.42 1.71 -13.85 51.13 -4.42 -12.40 coo 29.08 5.53 11.69 30.46 5.61 17.93 51.38 3.18 -10.50 55.68 5.47 -6.55 1p1x_c00 source 1p1x DEOXYRIBOSE-PHOSPHATE ALDOLASE : 1 hits 1p1x_c00 naa= 3 ULMN 3 1p1x_c01 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 1 3 # 1 B1102 ASP B 88 ASP~? 29.32 O1 SO4 B 202 B1167 LYS B 93 LYS~? 24.54 O1 SO4 B 202 B1201 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo 26.10 12.11 49.61 24.19 12.48 50.51 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 27.70 11.69 56.92 24.82 8.55 52.12 50.42 1.71 -13.85 51.13 -4.42 -12.40 coo 23.50 11.64 58.67 22.19 10.19 52.59 51.38 3.18 -10.50 55.68 5.47 -6.55 1p1x_c01 source 1p1x DEOXYRIBOSE-PHOSPHATE ALDOLASE : 1 hits 1p1x_c01 naa= 3 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 1 3 # 1 A 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 38 GLU A 83 GLU^? 22.48 O3 SO4 A 201 A 46 TRP A 132 TRP^? 22.33 O4 SO4 A 201 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 13.33 53.63 -17.82 12.09 54.13 -16.20 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 22.11 51.17 -22.96 25.69 51.25 -24.63 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 2 3 # 2 A 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 38 GLU B 83 GLU^? 22.50 O1 SO4 B 202 A 46 TRP B 132 TRP^? 21.63 CL CL B 203 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 43.22 15.26 -20.02 39.85 15.72 -22.02 1p7m_c00 source 1p7m DNA-3-METHYLADENINE GLYCOSYLASE I : 2 hits 1p7m_c00 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 25 ALA^? 11.51 CL CL B 203 A 126 LEU A 23 LEU^? 14.22 CL CL B 203 A 158 GLU A 53 GLU.? 13.05 O2 SO4 A 201 coo -2.29 37.66 144.73 -1.46 37.12 145.87 26.65 37.04 -8.29 26.16 38.39 -8.81 coo -4.62 32.83 147.14 -5.50 32.85 149.12 31.34 40.58 -10.77 29.26 41.06 -10.54 coo -0.83 29.57 149.77 -0.39 31.47 148.95 30.40 43.96 -5.99 31.90 43.40 -4.58 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 51 ALA.? 16.68 CL CL B 203 A 126 LEU A 23 LEU^? 14.22 CL CL B 203 A 158 GLU A 53 GLU.? 13.05 O2 SO4 A 201 coo -2.29 37.66 144.73 -1.46 37.12 145.87 27.24 44.22 -13.46 28.03 42.99 -13.87 coo -4.62 32.83 147.14 -5.50 32.85 149.12 31.34 40.58 -10.77 29.26 41.06 -10.54 coo -0.83 29.57 149.77 -0.39 31.47 148.95 30.40 43.96 -5.99 31.90 43.40 -4.58 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA A 103 ALA^? 18.27 O4 SO4 A 201 A 126 LEU A 80 LEU^? 12.76 O2 SO4 A 201 A 158 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo -2.29 37.66 144.73 -1.46 37.12 145.87 20.86 53.82 -18.94 21.82 52.66 -18.69 coo -4.62 32.83 147.14 -5.50 32.85 149.12 23.88 53.19 -12.38 24.02 52.47 -14.37 coo -0.83 29.57 149.77 -0.39 31.47 148.95 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA A 103 ALA^? 18.27 O4 SO4 A 201 A 126 LEU A 104 LEU^? 23.59 O4 SO4 A 201 A 158 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo -2.29 37.66 144.73 -1.46 37.12 145.87 20.86 53.82 -18.94 21.82 52.66 -18.69 coo -4.62 32.83 147.14 -5.50 32.85 149.12 16.98 54.40 -21.54 14.89 54.63 -22.04 coo -0.83 29.57 149.77 -0.39 31.47 148.95 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 A 70 ALA B 99 ALA^? 13.03 O1 SO4 B 202 A 126 LEU B 80 LEU^? 12.92 O4 SO4 B 202 A 158 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo -2.29 37.66 144.73 -1.46 37.12 145.87 43.79 6.64 -8.02 44.39 7.81 -8.78 coo -4.62 32.83 147.14 -5.50 32.85 149.12 41.53 13.61 -9.41 41.52 14.43 -11.47 coo -0.83 29.57 149.77 -0.39 31.47 148.95 39.44 10.40 -13.31 37.47 11.26 -13.58 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 5 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 25 ALA^? 11.51 CL CL B 203 B 126 LEU A 23 LEU^? 14.22 CL CL B 203 B 158 GLU A 53 GLU.? 13.05 O2 SO4 A 201 coo -39.79 4.61 147.27 -39.61 5.56 148.47 26.65 37.04 -8.29 26.16 38.39 -8.81 coo -34.22 5.06 149.25 -33.65 4.24 151.15 31.34 40.58 -10.77 29.26 41.06 -10.54 coo -33.03 9.93 151.71 -34.98 9.38 151.11 30.40 43.96 -5.99 31.90 43.40 -4.58 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 51 ALA.? 16.68 CL CL B 203 B 126 LEU A 23 LEU^? 14.22 CL CL B 203 B 158 GLU A 53 GLU.? 13.05 O2 SO4 A 201 coo -39.79 4.61 147.27 -39.61 5.56 148.47 27.24 44.22 -13.46 28.03 42.99 -13.87 coo -34.22 5.06 149.25 -33.65 4.24 151.15 31.34 40.58 -10.77 29.26 41.06 -10.54 coo -33.03 9.93 151.71 -34.98 9.38 151.11 30.40 43.96 -5.99 31.90 43.40 -4.58 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA A 103 ALA^? 18.27 O4 SO4 A 201 B 126 LEU A 80 LEU^? 12.76 O2 SO4 A 201 B 158 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo -39.79 4.61 147.27 -39.61 5.56 148.47 20.86 53.82 -18.94 21.82 52.66 -18.69 coo -34.22 5.06 149.25 -33.65 4.24 151.15 23.88 53.19 -12.38 24.02 52.47 -14.37 coo -33.03 9.93 151.71 -34.98 9.38 151.11 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 B 70 ALA B 99 ALA^? 13.03 O1 SO4 B 202 B 126 LEU B 80 LEU^? 12.92 O4 SO4 B 202 B 158 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo -39.79 4.61 147.27 -39.61 5.56 148.47 43.79 6.64 -8.02 44.39 7.81 -8.78 coo -34.22 5.06 149.25 -33.65 4.24 151.15 41.53 13.61 -9.41 41.52 14.43 -11.47 coo -33.03 9.93 151.71 -34.98 9.38 151.11 39.44 10.40 -13.31 37.47 11.26 -13.58 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 25 ALA^? 11.51 CL CL B 203 C 126 LEU A 23 LEU^? 14.22 CL CL B 203 C 158 GLU A 53 GLU.? 13.05 O2 SO4 A 201 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 26.65 37.04 -8.29 26.16 38.39 -8.81 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 31.34 40.58 -10.77 29.26 41.06 -10.54 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 30.40 43.96 -5.99 31.90 43.40 -4.58 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 51 ALA.? 16.68 CL CL B 203 C 126 LEU A 23 LEU^? 14.22 CL CL B 203 C 158 GLU A 53 GLU.? 13.05 O2 SO4 A 201 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 27.24 44.22 -13.46 28.03 42.99 -13.87 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 31.34 40.58 -10.77 29.26 41.06 -10.54 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 30.40 43.96 -5.99 31.90 43.40 -4.58 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA A 103 ALA^? 18.27 O4 SO4 A 201 C 126 LEU A 80 LEU^? 12.76 O2 SO4 A 201 C 158 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 20.86 53.82 -18.94 21.82 52.66 -18.69 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 23.88 53.19 -12.38 24.02 52.47 -14.37 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA A 103 ALA^? 18.27 O4 SO4 A 201 C 126 LEU A 104 LEU^? 23.59 O4 SO4 A 201 C 158 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 20.86 53.82 -18.94 21.82 52.66 -18.69 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 16.98 54.40 -21.54 14.89 54.63 -22.04 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 C 70 ALA B 99 ALA^? 13.03 O1 SO4 B 202 C 126 LEU B 80 LEU^? 12.92 O4 SO4 B 202 C 158 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 43.79 6.64 -8.02 44.39 7.81 -8.78 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 41.53 13.61 -9.41 41.52 14.43 -11.47 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 39.44 10.40 -13.31 37.47 11.26 -13.58 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 5 hits 1pjh_c02 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN A 56 GLN^? 14.51 O2 SO4 A 201 294 GLU A 53 GLU.? 13.05 O2 SO4 A 201 304 ARG A 72 ARG^? 12.89 O3 SO4 A 201 coo 15.89 18.45 46.53 15.82 16.91 48.02 20.56 45.76 -4.92 19.77 46.12 -2.95 coo 22.84 13.44 52.91 20.84 13.18 52.38 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 8.71 17.11 46.51 7.23 17.64 49.20 19.61 53.07 -4.13 17.97 51.61 -1.95 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 2 3 # 2 111 GLN B 21 GLN^? 7.95 CL CL B 203 294 GLU B 53 GLU.? 13.18 O4 SO4 B 202 304 ARG B 19 ARG.? 10.93 CL CL B 203 coo 15.89 18.45 46.53 15.82 16.91 48.02 32.77 24.18 -9.82 34.10 22.62 -9.28 coo 22.84 13.44 52.91 20.84 13.18 52.38 38.06 24.56 -1.39 36.59 24.51 0.17 coo 8.71 17.11 46.51 7.23 17.64 49.20 34.18 19.86 -14.65 35.93 20.77 -12.27 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 3 3 # 3 111 GLN B 56 GLN^? 14.86 O4 SO4 B 202 294 GLU B 53 GLU.? 13.18 O4 SO4 B 202 304 ARG B 72 ARG^? 12.97 O1 SO4 B 202 coo 15.89 18.45 46.53 15.82 16.91 48.02 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 22.84 13.44 52.91 20.84 13.18 52.38 38.06 24.56 -1.39 36.59 24.51 0.17 coo 8.71 17.11 46.51 7.23 17.64 49.20 45.42 12.48 -0.13 47.39 14.66 0.83 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 4 3 # 4 111 GLN B 56 GLN^? 14.86 O4 SO4 B 202 294 GLU B 66 GLU.? 19.61 O1 SO4 B 202 304 ARG B 54 ARG.? 5.08 O4 SO4 B 202 coo 15.89 18.45 46.53 15.82 16.91 48.02 45.68 20.37 -2.08 46.43 20.53 -0.09 coo 22.84 13.44 52.91 20.84 13.18 52.38 54.16 12.70 -3.87 54.28 14.29 -2.42 coo 8.71 17.11 46.51 7.23 17.64 49.20 37.77 18.62 -0.73 37.02 15.96 0.60 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 4 hits 1pmi_c00 naa= 3 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 # 1 B 1 SER A 109 SER~? 36.36 CL CL B 203 B 69 ALA A 111 ALA~? 36.44 O4 SO4 A 201 B 241 ASN A 108 ASN~? 34.79 CL CL B 203 coo 13.24 41.94 33.13 13.08 39.54 33.17 11.05 47.60 -32.89 11.53 46.95 -35.16 coo 9.15 37.89 36.69 10.55 37.76 37.22 7.08 51.06 -31.33 6.61 50.50 -30.00 coo 10.91 43.03 38.47 11.81 41.82 36.93 8.53 47.32 -28.63 6.99 46.32 -29.72 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 # 2 B 1 SER A 109 SER~? 36.36 CL CL B 203 B 69 ALA A 112 ALA~? 33.45 O4 SO4 A 201 B 241 ASN A 108 ASN~? 34.79 CL CL B 203 coo 13.24 41.94 33.13 13.08 39.54 33.17 11.05 47.60 -32.89 11.53 46.95 -35.16 coo 9.15 37.89 36.69 10.55 37.76 37.22 10.69 52.22 -30.73 11.84 51.26 -30.49 coo 10.91 43.03 38.47 11.81 41.82 36.93 8.53 47.32 -28.63 6.99 46.32 -29.72 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 3 3 # 3 B 1 SER B 109 SER~? 35.44 CL CL B 203 B 69 ALA B 111 ALA~? 36.75 O1 SO4 B 202 B 241 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 13.24 41.94 33.13 13.08 39.54 33.17 55.00 17.36 -30.57 53.91 19.30 -31.57 coo 9.15 37.89 36.69 10.55 37.76 37.22 58.44 13.32 -28.53 59.07 13.74 -27.20 coo 10.91 43.03 38.47 11.81 41.82 36.93 57.24 17.95 -26.18 59.03 17.74 -27.34 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 4 3 # 4 B 1 SER B 109 SER~? 35.44 CL CL B 203 B 69 ALA B 112 ALA~? 33.71 O2 SO4 B 202 B 241 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 13.24 41.94 33.13 13.08 39.54 33.17 55.00 17.36 -30.57 53.91 19.30 -31.57 coo 9.15 37.89 36.69 10.55 37.76 37.22 54.69 12.77 -27.96 53.71 13.86 -27.54 coo 10.91 43.03 38.47 11.81 41.82 36.93 57.24 17.95 -26.18 59.03 17.74 -27.34 1pnl_c00 source 1pnl PENICILLIN AMIDOHYDROLASE : 4 hits 1pnl_c00 naa= 3 ULMN 3 1pow_c02 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 1 3 # 1 A 264 ARG A 43 ARG~? 21.16 CL CL B 203 A 479 PHE A 57 PHE^? 18.81 CL CL B 203 A 483 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 17.33 52.29 2.24 18.71 54.03 0.18 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 20.06 57.44 1.28 18.39 56.19 3.12 16.75 43.27 -10.69 18.19 42.18 -12.78 coo 17.33 54.96 -3.04 16.34 56.76 -2.51 13.06 47.55 -15.25 11.61 49.09 -15.60 1pow_c02 source 1pow PYRUVATE OXIDASE (E.C.1.2.3.3) (WILD TYPE) : 1 hits 1pow_c02 naa= 3 ULMN 3 1pow_c03 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 1 3 # 1 B 264 ARG A 43 ARG~? 21.16 CL CL B 203 B 479 PHE A 57 PHE^? 18.81 CL CL B 203 B 483 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo -26.72 93.28 20.13 -28.02 93.55 17.39 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -29.34 90.48 15.69 -27.62 89.95 17.80 16.75 43.27 -10.69 18.19 42.18 -12.78 coo -26.63 95.49 14.65 -25.77 93.77 13.77 13.06 47.55 -15.25 11.61 49.09 -15.60 1pow_c03 source 1pow PYRUVATE OXIDASE (E.C.1.2.3.3) (WILD TYPE) : 1 hits 1pow_c03 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 17 LEU.? 21.11 CL CL B 203 A 58 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 120 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 34.02 69.29 75.26 34.82 67.82 76.74 37.67 41.92 -21.53 37.77 39.73 -21.34 coo 34.46 72.45 78.57 32.82 72.75 77.28 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 28.96 77.64 81.19 29.05 74.53 77.51 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 A 48 LEU A 71 LEU^? 9.11 O2 SO4 A 201 A 58 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 120 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 34.02 69.29 75.26 34.82 67.82 76.74 24.32 51.19 -8.85 26.47 51.20 -8.48 coo 34.46 72.45 78.57 32.82 72.75 77.28 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 28.96 77.64 81.19 29.05 74.53 77.51 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 3 3 # 3 A 48 LEU B 17 LEU.? 9.88 CL CL B 203 A 58 ASP B 16 ASP^? 10.11 CL CL B 203 A 120 LYS B 49 LYS~? 17.28 CL CL B 203 coo 34.02 69.29 75.26 34.82 67.82 76.74 29.35 26.29 -18.98 28.83 28.43 -19.06 coo 34.46 72.45 78.57 32.82 72.75 77.28 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 28.96 77.64 81.19 29.05 74.53 77.51 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 4 3 # 4 A 48 LEU B 17 LEU.? 9.88 CL CL B 203 A 58 ASP B 18 ASP.? 13.73 CL CL B 203 A 120 LYS B 49 LYS~? 17.28 CL CL B 203 coo 34.02 69.29 75.26 34.82 67.82 76.74 29.35 26.29 -18.98 28.83 28.43 -19.06 coo 34.46 72.45 78.57 32.82 72.75 77.28 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 28.96 77.64 81.19 29.05 74.53 77.51 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 5 3 # 5 A 48 LEU B 71 LEU^? 9.34 O4 SO4 B 202 A 58 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 120 LYS B 49 LYS~? 17.28 CL CL B 203 coo 34.02 69.29 75.26 34.82 67.82 76.74 41.42 15.71 -5.96 39.29 16.12 -5.49 coo 34.46 72.45 78.57 32.82 72.75 77.28 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 28.96 77.64 81.19 29.05 74.53 77.51 40.33 21.93 -16.14 38.56 18.89 -19.75 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 5 hits 1pym_c00 naa= 3 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 B 48 LEU A 17 LEU.? 21.11 CL CL B 203 B 58 ASP A 16 ASP^? 19.84 O2 SO4 A 201 B 120 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 54.50 104.32 58.69 55.83 105.69 59.81 37.67 41.92 -21.53 37.77 39.73 -21.34 coo 57.63 101.19 59.83 56.60 100.89 57.99 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 61.58 95.88 55.22 58.18 99.30 54.71 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 B 48 LEU A 17 LEU.? 21.11 CL CL B 203 B 58 ASP A 18 ASP.? 23.99 O2 SO4 A 201 B 120 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 54.50 104.32 58.69 55.83 105.69 59.81 37.67 41.92 -21.53 37.77 39.73 -21.34 coo 57.63 101.19 59.83 56.60 100.89 57.99 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 61.58 95.88 55.22 58.18 99.30 54.71 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 3 3 # 3 B 48 LEU A 71 LEU^? 9.11 O2 SO4 A 201 B 58 ASP A 52 ASP.? 10.10 O2 SO4 A 201 B 120 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 54.50 104.32 58.69 55.83 105.69 59.81 24.32 51.19 -8.85 26.47 51.20 -8.48 coo 57.63 101.19 59.83 56.60 100.89 57.99 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 61.58 95.88 55.22 58.18 99.30 54.71 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 4 3 # 4 B 48 LEU B 17 LEU.? 9.88 CL CL B 203 B 58 ASP B 16 ASP^? 10.11 CL CL B 203 B 120 LYS B 49 LYS~? 17.28 CL CL B 203 coo 54.50 104.32 58.69 55.83 105.69 59.81 29.35 26.29 -18.98 28.83 28.43 -19.06 coo 57.63 101.19 59.83 56.60 100.89 57.99 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 61.58 95.88 55.22 58.18 99.30 54.71 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 5 3 # 5 B 48 LEU B 17 LEU.? 9.88 CL CL B 203 B 58 ASP B 18 ASP.? 13.73 CL CL B 203 B 120 LYS B 49 LYS~? 17.28 CL CL B 203 coo 54.50 104.32 58.69 55.83 105.69 59.81 29.35 26.29 -18.98 28.83 28.43 -19.06 coo 57.63 101.19 59.83 56.60 100.89 57.99 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 61.58 95.88 55.22 58.18 99.30 54.71 40.33 21.93 -16.14 38.56 18.89 -19.75 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 6 3 # 6 B 48 LEU B 71 LEU^? 9.34 O4 SO4 B 202 B 58 ASP B 52 ASP.? 10.23 O4 SO4 B 202 B 120 LYS B 49 LYS~? 17.28 CL CL B 203 coo 54.50 104.32 58.69 55.83 105.69 59.81 41.42 15.71 -5.96 39.29 16.12 -5.49 coo 57.63 101.19 59.83 56.60 100.89 57.99 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 61.58 95.88 55.22 58.18 99.30 54.71 40.33 21.93 -16.14 38.56 18.89 -19.75 1pym_c01 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 6 hits 1pym_c01 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 68 ALA A 15 ALA^? 15.74 CL CL B 203 A 72 LEU A 23 LEU^? 14.22 CL CL B 203 coo 46.76 7.59 18.65 45.27 6.01 18.52 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 48.88 4.35 16.59 48.73 5.09 15.20 34.01 39.06 -17.24 34.91 37.94 -17.73 coo 53.89 6.25 15.09 52.88 7.92 14.14 31.34 40.58 -10.77 29.26 41.06 -10.54 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 68 ALA A 51 ALA.? 16.68 CL CL B 203 A 72 LEU A 23 LEU^? 14.22 CL CL B 203 coo 46.76 7.59 18.65 45.27 6.01 18.52 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 48.88 4.35 16.59 48.73 5.09 15.20 27.24 44.22 -13.46 28.03 42.99 -13.87 coo 53.89 6.25 15.09 52.88 7.92 14.14 31.34 40.58 -10.77 29.26 41.06 -10.54 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 # 3 A 67 ASP B 16 ASP^? 10.11 CL CL B 203 A 68 ALA B 15 ALA^? 9.07 CL CL B 203 A 72 LEU B 23 LEU^? 9.27 CL CL B 203 coo 46.76 7.59 18.65 45.27 6.01 18.52 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 48.88 4.35 16.59 48.73 5.09 15.20 33.44 29.49 -14.78 32.88 30.75 -15.46 coo 53.89 6.25 15.09 52.88 7.92 14.14 35.67 27.27 -8.34 37.56 26.37 -7.80 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 # 4 A 67 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 68 ALA B 51 ALA.? 11.87 CL CL B 203 A 72 LEU B 23 LEU^? 9.27 CL CL B 203 coo 46.76 7.59 18.65 45.27 6.01 18.52 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 48.88 4.35 16.59 48.73 5.09 15.20 39.36 22.85 -10.60 38.84 24.20 -11.02 coo 53.89 6.25 15.09 52.88 7.92 14.14 35.67 27.27 -8.34 37.56 26.37 -7.80 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 4 hits 1q6l_c05 naa= 3 ULMN 3 1qaz_c00 ALGINATE LYASE A1-III user 1 3 # 1 A 191 ASN A 108 ASN~? 34.79 CL CL B 203 A 239 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 246 TYR A 107 TYR.? 29.41 CL CL B 203 coo 2.50 7.27 18.06 0.76 7.28 16.81 8.53 47.32 -28.63 6.99 46.32 -29.72 coo -1.16 0.95 13.41 -2.50 3.71 13.61 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 1.59 5.18 12.30 -0.74 6.52 11.61 12.10 46.09 -25.36 9.95 46.06 -23.57 ULMN 3 1qaz_c00 ALGINATE LYASE A1-III user 2 3 # 2 A 191 ASN B 108 ASN~? 37.31 O4 SO4 B 202 A 239 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 246 TYR B 107 TYR.? 30.85 O4 SO4 B 202 coo 2.50 7.27 18.06 0.76 7.28 16.81 57.24 17.95 -26.18 59.03 17.74 -27.34 coo -1.16 0.95 13.41 -2.50 3.71 13.61 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 1.59 5.18 12.30 -0.74 6.52 11.61 54.19 18.98 -22.56 56.19 18.89 -20.60 1qaz_c00 source 1qaz ALGINATE LYASE A1-III : 2 hits 1qaz_c00 naa= 3 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 581 ARG A 43 ARG~? 21.16 CL CL B 203 A 713 ARG A 31 ARG^? 24.05 CL CL B 203 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG A 43 ARG~? 21.16 CL CL B 203 A 581 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 713 ARG A 31 ARG^? 24.05 CL CL B 203 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 3 3 # 3 A 396 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 581 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 713 ARG B 31 ARG^? 34.85 CL CL B 203 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 59.17 28.21 -12.86 61.91 28.73 -14.07 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 4 3 # 4 A 396 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 581 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 713 ARG B 31 ARG^? 34.85 CL CL B 203 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 59.17 28.21 -12.86 61.91 28.73 -14.07 1qb4_c01 source 1qb4 PHOSPHOENOLPYRUVATE CARBOXYLASE : 4 hits 1qb4_c01 naa= 3 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 A 236 ASP B 147 ASP.? 29.53 CL CL B 203 A 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 55.45 46.76 42.08 57.34 46.16 42.75 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 48.87 29.19 44.63 49.10 27.34 43.63 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 47.58 17.35 41.83 51.40 20.85 40.83 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c00 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c00 naa= 3 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 B 236 ASP B 147 ASP.? 29.53 CL CL B 203 B 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c01 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c01 naa= 3 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 C 236 ASP B 147 ASP.? 29.53 CL CL B 203 C 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 55.11 47.10 12.61 53.44 47.85 11.58 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 45.78 31.11 9.51 44.25 30.06 10.53 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 37.54 22.37 12.10 37.83 27.55 13.24 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c02 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c02 naa= 3 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 D 236 ASP B 147 ASP.? 29.53 CL CL B 203 D 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c03 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c03 naa= 3 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 E 236 ASP B 147 ASP.? 29.53 CL CL B 203 E 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c04 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c04 naa= 3 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 F 236 ASP B 147 ASP.? 29.53 CL CL B 203 F 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c05 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c05 naa= 3 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 G 236 ASP B 147 ASP.? 29.53 CL CL B 203 G 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c06 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c06 naa= 3 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 155 HIS B 32 HIS.? 32.94 O4 SO4 B 202 H 236 ASP B 147 ASP.? 29.53 CL CL B 203 H 261 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 46.06 42.14 -21.13 50.44 45.35 -19.26 1qgn_c07 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c07 naa= 3 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 107 TYR.? 29.41 CL CL B 203 A 236 ASP A 135 ASP~? 30.53 CL CL B 203 A 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 55.48 26.51 40.65 55.39 23.99 39.43 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 48.87 29.19 44.63 49.10 27.34 43.63 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 47.58 17.35 41.83 51.40 20.85 40.83 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 A 236 ASP B 135 ASP~? 30.33 CL CL B 203 A 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 55.48 26.51 40.65 55.39 23.99 39.43 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 48.87 29.19 44.63 49.10 27.34 43.63 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 47.58 17.35 41.83 51.40 20.85 40.83 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c08 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c08 naa= 3 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 107 TYR.? 29.41 CL CL B 203 B 236 ASP A 135 ASP~? 30.53 CL CL B 203 B 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 B 236 ASP B 135 ASP~? 30.33 CL CL B 203 B 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c09 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c09 naa= 3 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 163 TYR A 107 TYR.? 29.41 CL CL B 203 C 236 ASP A 135 ASP~? 30.53 CL CL B 203 C 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 39.51 34.34 13.63 37.63 32.61 14.79 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 45.78 31.11 9.51 44.25 30.06 10.53 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 37.54 22.37 12.10 37.83 27.55 13.24 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 C 236 ASP B 135 ASP~? 30.33 CL CL B 203 C 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 39.51 34.34 13.63 37.63 32.61 14.79 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 45.78 31.11 9.51 44.25 30.06 10.53 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 37.54 22.37 12.10 37.83 27.55 13.24 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c10 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c10 naa= 3 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 163 TYR A 107 TYR.? 29.41 CL CL B 203 D 236 ASP A 135 ASP~? 30.53 CL CL B 203 D 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 D 236 ASP B 135 ASP~? 30.33 CL CL B 203 D 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c11 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c11 naa= 3 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 107 TYR.? 29.41 CL CL B 203 E 236 ASP A 135 ASP~? 30.53 CL CL B 203 E 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 E 236 ASP B 135 ASP~? 30.33 CL CL B 203 E 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c12 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c12 naa= 3 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 107 TYR.? 29.41 CL CL B 203 F 236 ASP A 135 ASP~? 30.53 CL CL B 203 F 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 F 236 ASP B 135 ASP~? 30.33 CL CL B 203 F 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c13 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c13 naa= 3 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 163 TYR A 107 TYR.? 29.41 CL CL B 203 G 236 ASP A 135 ASP~? 30.53 CL CL B 203 G 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 G 236 ASP B 135 ASP~? 30.33 CL CL B 203 G 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c14 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c14 naa= 3 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 163 TYR A 107 TYR.? 29.41 CL CL B 203 H 236 ASP A 135 ASP~? 30.53 CL CL B 203 H 261 LYS A 141 LYS~? 27.34 CL CL B 203 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 163 TYR B 107 TYR.? 30.85 O4 SO4 B 202 H 236 ASP B 135 ASP~? 30.33 CL CL B 203 H 261 LYS B 141 LYS~? 32.09 CL CL B 203 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 50.65 30.91 -26.07 50.03 31.36 -31.64 1qgn_c15 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c15 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG A 43 ARG~? 21.16 CL CL B 203 C 163 TYR A 8 TYR^? 17.88 CL CL B 203 C 236 ASP A 147 ASP.? 14.36 CL CL B 203 coo 39.01 29.77 22.02 37.48 31.30 19.84 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 39.51 34.34 13.63 37.63 32.61 14.79 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 45.78 31.11 9.51 44.25 30.06 10.53 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 C 163 TYR B 8 TYR^? 29.42 CL CL B 203 C 236 ASP B 147 ASP.? 29.53 CL CL B 203 coo 39.01 29.77 22.02 37.48 31.30 19.84 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 39.51 34.34 13.63 37.63 32.61 14.79 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 45.78 31.11 9.51 44.25 30.06 10.53 52.99 37.46 -14.27 53.96 39.20 -13.53 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 43 ARG~? 21.16 CL CL B 203 D 163 TYR A 8 TYR^? 17.88 CL CL B 203 D 236 ASP A 147 ASP.? 14.36 CL CL B 203 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 D 163 TYR B 8 TYR^? 29.42 CL CL B 203 D 236 ASP B 147 ASP.? 29.53 CL CL B 203 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 52.99 37.46 -14.27 53.96 39.20 -13.53 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 8 TYR^? 17.88 CL CL B 203 A 236 ASP A 147 ASP.? 14.36 CL CL B 203 C 110 ARG A 43 ARG~? 21.16 CL CL B 203 coo 55.48 26.51 40.65 55.39 23.99 39.43 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 48.87 29.19 44.63 49.10 27.34 43.63 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 52.39 23.42 32.10 54.51 23.27 34.29 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 8 TYR^? 29.42 CL CL B 203 A 236 ASP B 147 ASP.? 29.53 CL CL B 203 C 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 55.48 26.51 40.65 55.39 23.99 39.43 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 48.87 29.19 44.63 49.10 27.34 43.63 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 52.39 23.42 32.10 54.51 23.27 34.29 52.54 21.81 -11.81 54.35 23.52 -10.03 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 8 TYR^? 17.88 CL CL B 203 B 236 ASP A 147 ASP.? 14.36 CL CL B 203 D 110 ARG A 43 ARG~? 21.16 CL CL B 203 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 8 TYR^? 29.42 CL CL B 203 B 236 ASP B 147 ASP.? 29.53 CL CL B 203 D 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 52.54 21.81 -11.81 54.35 23.52 -10.03 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG A 43 ARG~? 21.16 CL CL B 203 G 163 TYR A 8 TYR^? 17.88 CL CL B 203 G 236 ASP A 147 ASP.? 14.36 CL CL B 203 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 G 163 TYR B 8 TYR^? 29.42 CL CL B 203 G 236 ASP B 147 ASP.? 29.53 CL CL B 203 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 52.99 37.46 -14.27 53.96 39.20 -13.53 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 43 ARG~? 21.16 CL CL B 203 H 163 TYR A 8 TYR^? 17.88 CL CL B 203 H 236 ASP A 147 ASP.? 14.36 CL CL B 203 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 H 163 TYR B 8 TYR^? 29.42 CL CL B 203 H 236 ASP B 147 ASP.? 29.53 CL CL B 203 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 52.99 37.46 -14.27 53.96 39.20 -13.53 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 8 TYR^? 17.88 CL CL B 203 E 236 ASP A 147 ASP.? 14.36 CL CL B 203 G 110 ARG A 43 ARG~? 21.16 CL CL B 203 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 8 TYR^? 29.42 CL CL B 203 E 236 ASP B 147 ASP.? 29.53 CL CL B 203 G 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 52.54 21.81 -11.81 54.35 23.52 -10.03 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 8 TYR^? 17.88 CL CL B 203 F 236 ASP A 147 ASP.? 14.36 CL CL B 203 H 110 ARG A 43 ARG~? 21.16 CL CL B 203 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 8 TYR^? 29.42 CL CL B 203 F 236 ASP B 147 ASP.? 29.53 CL CL B 203 H 110 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 52.54 21.81 -11.81 54.35 23.52 -10.03 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c23 naa= 3 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 # 1 A 49 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 147 THR A 155 THR^? 16.70 CL CL B 203 A 294 ASP A 24 ASP^? 8.56 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 32.10 37.97 -21.41 33.49 36.33 -21.72 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 # 2 A 49 ASP A 24 ASP^? 8.56 CL CL B 203 A 147 THR A 11 THR^? 4.56 CL CL B 203 A 294 ASP A 165 ASP.? 13.91 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 24.05 32.29 -10.90 24.73 30.60 -9.78 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 # 3 A 49 ASP A 24 ASP^? 8.56 CL CL B 203 A 147 THR A 11 THR^? 4.56 CL CL B 203 A 294 ASP B 16 ASP^? 10.11 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 24.05 32.29 -10.90 24.73 30.60 -9.78 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 # 4 A 49 ASP A 165 ASP.? 13.91 CL CL B 203 A 147 THR A 151 THR^? 5.27 CL CL B 203 A 294 ASP A 24 ASP^? 8.56 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 23.61 29.36 -14.77 24.70 27.83 -13.70 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 5 3 # 5 A 49 ASP A 165 ASP.? 13.91 CL CL B 203 A 147 THR A 151 THR^? 5.27 CL CL B 203 A 294 ASP B 16 ASP^? 10.11 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 23.61 29.36 -14.77 24.70 27.83 -13.70 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 6 3 # 6 A 49 ASP B 16 ASP^? 10.11 CL CL B 203 A 147 THR B 155 THR^? 12.79 CL CL B 203 A 294 ASP A 24 ASP^? 8.56 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 35.45 29.84 -18.92 33.82 31.13 -19.55 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 7 3 # 7 A 49 ASP B 16 ASP^? 10.11 CL CL B 203 A 147 THR B 155 THR^? 12.79 CL CL B 203 A 294 ASP A 165 ASP.? 13.91 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 35.45 29.84 -18.92 33.82 31.13 -19.55 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 8 3 # 8 A 49 ASP B 16 ASP^? 10.11 CL CL B 203 A 147 THR B 155 THR^? 12.79 CL CL B 203 A 294 ASP B 24 ASP^? 11.11 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 35.45 29.84 -18.92 33.82 31.13 -19.55 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 9 3 # 9 A 49 ASP B 24 ASP^? 11.11 CL CL B 203 A 147 THR B 11 THR^? 18.63 CL CL B 203 A 294 ASP B 165 ASP.? 24.35 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 44.15 34.34 -8.16 43.53 36.08 -7.10 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 45.25 37.97 -17.38 46.58 38.45 -18.99 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 10 3 # 10 A 49 ASP B 165 ASP.? 24.35 CL CL B 203 A 147 THR B 151 THR^? 20.59 CL CL B 203 A 294 ASP B 24 ASP^? 11.11 CL CL B 203 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 45.05 37.16 -12.09 44.11 38.87 -11.18 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 37.06 32.38 -6.05 35.96 33.77 -7.20 1qgx_c02 source 1qgx 3',5'-ADENOSINE BISPHOSPHATASE : 10 hits 1qgx_c02 naa= 3 ULMN 3 1qho_c04 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 256 GLU A 53 GLU.? 13.05 O2 SO4 A 201 A 329 ASP A 24 ASP^? 8.56 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 30.54 71.65 32.58 31.73 72.26 30.92 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 37.87 70.12 31.80 36.61 69.74 30.15 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1qho_c04 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 256 GLU B 53 GLU.? 13.18 O4 SO4 B 202 A 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 30.54 71.65 32.58 31.73 72.26 30.92 38.06 24.56 -1.39 36.59 24.51 0.17 coo 37.87 70.12 31.80 36.61 69.74 30.15 37.06 32.38 -6.05 35.96 33.77 -7.20 1qho_c04 source 1qho ALPHA-AMYLASE : 2 hits 1qho_c04 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 24 ASP^? 8.56 CL CL B 203 A 261 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 329 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 34.02 79.89 42.60 34.73 78.01 41.86 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 37.87 70.12 31.80 36.61 69.74 30.15 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 261 ASP B 24 ASP^? 11.11 CL CL B 203 A 329 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 34.02 79.89 42.60 34.73 78.01 41.86 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1qho_c05 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 261 ASP B 165 ASP.? 24.35 CL CL B 203 A 329 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 34.02 79.89 42.60 34.73 78.01 41.86 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1qho_c05 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 261 ASP B 165 ASP.? 24.35 CL CL B 203 A 329 ASP A 24 ASP^? 8.56 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 34.02 79.89 42.60 34.73 78.01 41.86 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1qho_c05 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 261 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 329 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 34.02 79.89 42.60 34.73 78.01 41.86 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 37.87 70.12 31.80 36.61 69.74 30.15 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1qho_c05 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP A 147 ASP.? 14.36 CL CL B 203 A 261 ASP A 24 ASP^? 8.56 CL CL B 203 A 329 ASP A 166 ASP.? 11.63 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 34.02 79.89 42.60 34.73 78.01 41.86 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 37.87 70.12 31.80 36.61 69.74 30.15 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1qho_c05 ALPHA-AMYLASE user 7 3 # 7 A 228 ASP B 16 ASP^? 10.11 CL CL B 203 A 261 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 34.02 79.89 42.60 34.73 78.01 41.86 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 37.87 70.12 31.80 36.61 69.74 30.15 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1qho_c05 ALPHA-AMYLASE user 8 3 # 8 A 228 ASP B 16 ASP^? 10.11 CL CL B 203 A 261 ASP B 165 ASP.? 24.35 CL CL B 203 A 329 ASP A 24 ASP^? 8.56 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 34.02 79.89 42.60 34.73 78.01 41.86 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1qho_c05 ALPHA-AMYLASE user 9 3 # 9 A 228 ASP B 16 ASP^? 10.11 CL CL B 203 A 261 ASP B 165 ASP.? 24.35 CL CL B 203 A 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 34.02 79.89 42.60 34.73 78.01 41.86 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1qho_c05 ALPHA-AMYLASE user 10 3 # 10 A 228 ASP B 16 ASP^? 10.11 CL CL B 203 A 261 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 34.02 79.89 42.60 34.73 78.01 41.86 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 37.87 70.12 31.80 36.61 69.74 30.15 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1qho_c05 ALPHA-AMYLASE user 11 3 # 11 A 228 ASP B 18 ASP.? 13.73 CL CL B 203 A 261 ASP A 24 ASP^? 8.56 CL CL B 203 A 329 ASP A 165 ASP.? 13.91 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 34.02 79.89 42.60 34.73 78.01 41.86 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 37.87 70.12 31.80 36.61 69.74 30.15 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1qho_c05 ALPHA-AMYLASE user 12 3 # 12 A 228 ASP B 24 ASP^? 11.11 CL CL B 203 A 261 ASP B 18 ASP.? 13.73 CL CL B 203 A 329 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 28.46 69.88 26.74 30.40 70.70 26.53 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 34.02 79.89 42.60 34.73 78.01 41.86 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 37.87 70.12 31.80 36.61 69.74 30.15 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1qho_c05 ALPHA-AMYLASE user 13 3 # 13 A 228 ASP B 24 ASP^? 11.11 CL CL B 203 A 261 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 34.02 79.89 42.60 34.73 78.01 41.86 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1qho_c05 ALPHA-AMYLASE user 14 3 # 14 A 228 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 261 ASP B 165 ASP.? 24.35 CL CL B 203 A 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 34.02 79.89 42.60 34.73 78.01 41.86 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1qho_c05 ALPHA-AMYLASE user 15 3 # 15 A 228 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 261 ASP B 18 ASP.? 13.73 CL CL B 203 A 329 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 28.46 69.88 26.74 30.40 70.70 26.53 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 34.02 79.89 42.60 34.73 78.01 41.86 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 37.87 70.12 31.80 36.61 69.74 30.15 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1qho_c05 ALPHA-AMYLASE user 16 3 # 16 A 228 ASP B 147 ASP.? 29.53 CL CL B 203 A 261 ASP B 24 ASP^? 11.11 CL CL B 203 A 329 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 34.02 79.89 42.60 34.73 78.01 41.86 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 37.87 70.12 31.80 36.61 69.74 30.15 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1qho_c05 ALPHA-AMYLASE user 17 3 # 17 A 228 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 261 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 329 ASP A 18 ASP.? 23.99 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 34.02 79.89 42.60 34.73 78.01 41.86 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 37.87 70.12 31.80 36.61 69.74 30.15 35.31 47.04 -22.18 34.84 45.98 -23.97 1qho_c05 source 1qho ALPHA-AMYLASE : 17 hits 1qho_c05 naa= 3 ULMN 3 1qho_c07 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 158 ASP.? 28.53 CL CL B 203 A 260 ASP B 165 ASP.? 24.35 CL CL B 203 A 329 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 30.73 81.29 37.61 31.23 82.07 35.69 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1qho_c07 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 165 ASP.? 13.91 CL CL B 203 A 260 ASP A 24 ASP^? 8.56 CL CL B 203 A 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.73 81.29 37.61 31.23 82.07 35.69 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1qho_c07 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 166 ASP.? 11.63 CL CL B 203 A 260 ASP A 24 ASP^? 8.56 CL CL B 203 A 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 30.73 81.29 37.61 31.23 82.07 35.69 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1qho_c07 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP B 16 ASP^? 10.11 CL CL B 203 A 260 ASP B 165 ASP.? 24.35 CL CL B 203 A 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 30.73 81.29 37.61 31.23 82.07 35.69 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1qho_c07 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP B 18 ASP.? 13.73 CL CL B 203 A 260 ASP A 24 ASP^? 8.56 CL CL B 203 A 329 ASP A 165 ASP.? 13.91 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 30.73 81.29 37.61 31.23 82.07 35.69 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 37.87 70.12 31.80 36.61 69.74 30.15 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1qho_c07 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 260 ASP A 24 ASP^? 8.56 CL CL B 203 A 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 28.46 69.88 26.74 30.40 70.70 26.53 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 30.73 81.29 37.61 31.23 82.07 35.69 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1qho_c07 ALPHA-AMYLASE user 7 3 # 7 A 228 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 260 ASP B 18 ASP.? 13.73 CL CL B 203 A 329 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 28.46 69.88 26.74 30.40 70.70 26.53 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 30.73 81.29 37.61 31.23 82.07 35.69 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 37.87 70.12 31.80 36.61 69.74 30.15 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1qho_c07 ALPHA-AMYLASE user 8 3 # 8 A 228 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 260 ASP A 24 ASP^? 8.56 CL CL B 203 A 329 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 30.73 81.29 37.61 31.23 82.07 35.69 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.21 43.75 -17.91 32.76 45.38 -19.21 1qho_c07 source 1qho ALPHA-AMYLASE : 8 hits 1qho_c07 naa= 3 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 1 3 # 1 A 145 THR A 28 THR^? 14.97 CL CL B 203 A 182 TYR A 8 TYR^? 17.88 CL CL B 203 A 186 LYS A 9 LYS^? 13.80 CL CL B 203 coo 69.38 87.38 24.64 71.11 88.47 25.40 16.85 36.90 -7.98 16.09 36.18 -6.07 coo 73.61 90.42 31.12 71.36 89.66 29.64 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 73.54 84.00 28.64 69.01 86.68 29.71 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 2 3 # 2 A 145 THR A 149 THR^? 9.97 CL CL B 203 A 182 TYR A 8 TYR^? 17.88 CL CL B 203 A 186 LYS A 9 LYS^? 13.80 CL CL B 203 coo 69.38 87.38 24.64 71.11 88.47 25.40 17.06 28.19 -12.48 17.57 26.94 -10.79 coo 73.61 90.42 31.12 71.36 89.66 29.64 12.62 33.51 -13.43 10.33 33.14 -15.03 coo 73.54 84.00 28.64 69.01 86.68 29.71 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 3 3 # 3 A 145 THR B 149 THR^? 27.09 CL CL B 203 A 182 TYR B 8 TYR^? 29.42 CL CL B 203 A 186 LYS B 9 LYS^? 26.01 CL CL B 203 coo 69.38 87.38 24.64 71.11 88.47 25.40 51.72 37.30 -9.59 51.54 39.31 -8.76 coo 73.61 90.42 31.12 71.36 89.66 29.64 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 73.54 84.00 28.64 69.01 86.68 29.71 50.82 33.22 -7.07 51.79 32.01 -1.71 1qrr_c01 source 1qrr SULFOLIPID BIOSYNTHESIS (SQD1) PROTEIN : 3 hits 1qrr_c01 naa= 3 ULMN 3 1qz9_c02 KYNURENINASE user 1 3 # 1 A 129 PHE A 22 PHE^? 18.06 CL CL B 203 A 201 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 227 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 23.39 49.81 32.16 21.33 51.68 32.26 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 25.52 45.12 37.98 23.98 46.65 37.85 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 12.68 46.83 36.69 18.26 48.67 34.51 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 1qz9_c02 KYNURENINASE user 2 3 # 2 A 129 PHE A 22 PHE^? 18.06 CL CL B 203 A 201 ASP A 24 ASP^? 8.56 CL CL B 203 A 227 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 23.39 49.81 32.16 21.33 51.68 32.26 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 25.52 45.12 37.98 23.98 46.65 37.85 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 12.68 46.83 36.69 18.26 48.67 34.51 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 1qz9_c02 KYNURENINASE user 3 3 # 3 A 129 PHE B 22 PHE^? 5.22 CL CL B 203 A 201 ASP A 24 ASP^? 8.56 CL CL B 203 A 227 LYS A 9 LYS^? 13.80 CL CL B 203 coo 23.39 49.81 32.16 21.33 51.68 32.26 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 25.52 45.12 37.98 23.98 46.65 37.85 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 12.68 46.83 36.69 18.26 48.67 34.51 17.34 32.48 -9.89 16.06 33.15 -4.52 ULMN 3 1qz9_c02 KYNURENINASE user 4 3 # 4 A 129 PHE B 22 PHE^? 5.22 CL CL B 203 A 201 ASP B 24 ASP^? 11.11 CL CL B 203 A 227 LYS B 49 LYS~? 17.28 CL CL B 203 coo 23.39 49.81 32.16 21.33 51.68 32.26 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 25.52 45.12 37.98 23.98 46.65 37.85 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 12.68 46.83 36.69 18.26 48.67 34.51 40.33 21.93 -16.14 38.56 18.89 -19.75 1qz9_c02 source 1qz9 KYNURENINASE : 4 hits 1qz9_c02 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 88 ASP~? 29.34 O3 SO4 A 201 A 186 ASN A 119 ASN~? 31.45 O4 SO4 A 201 A 260 ALA A 111 ALA~? 36.44 O4 SO4 A 201 coo 11.81 33.10 11.71 13.07 31.45 11.40 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 11.43 26.53 7.41 13.01 27.56 8.43 11.73 60.90 -27.86 9.72 60.89 -27.11 coo 21.53 26.33 6.96 20.26 25.69 7.52 7.08 51.06 -31.33 6.61 50.50 -30.00 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 # 2 A 10 ASP A 88 ASP~? 29.34 O3 SO4 A 201 A 186 ASN A 119 ASN~? 31.45 O4 SO4 A 201 A 260 ALA A 112 ALA~? 33.45 O4 SO4 A 201 coo 11.81 33.10 11.71 13.07 31.45 11.40 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 11.43 26.53 7.41 13.01 27.56 8.43 11.73 60.90 -27.86 9.72 60.89 -27.11 coo 21.53 26.33 6.96 20.26 25.69 7.52 10.69 52.22 -30.73 11.84 51.26 -30.49 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 3 3 # 3 A 10 ASP A 135 ASP~? 30.53 CL CL B 203 A 186 ASN A 173 ASN.? 27.41 CL CL B 203 A 260 ALA A 176 ALA^? 25.90 O4 SO4 A 201 coo 11.81 33.10 11.71 13.07 31.45 11.40 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 11.43 26.53 7.41 13.01 27.56 8.43 25.34 43.35 -31.46 27.19 42.45 -31.89 coo 21.53 26.33 6.96 20.26 25.69 7.52 24.03 52.68 -28.87 25.48 53.02 -28.55 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 4 3 # 4 A 10 ASP A 165 ASP.? 13.91 CL CL B 203 A 186 ASN B 20 ASN.? 4.66 CL CL B 203 A 260 ALA B 15 ALA^? 9.07 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 11.43 26.53 7.41 13.01 27.56 8.43 26.68 23.02 -13.35 25.29 24.43 -12.57 coo 21.53 26.33 6.96 20.26 25.69 7.52 33.44 29.49 -14.78 32.88 30.75 -15.46 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 5 3 # 5 A 10 ASP A 166 ASP.? 11.63 CL CL B 203 A 186 ASN A 168 ASN.? 18.60 CL CL B 203 A 260 ALA A 144 ALA~? 20.95 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 11.43 26.53 7.41 13.01 27.56 8.43 22.93 27.85 -26.42 21.77 26.15 -26.99 coo 21.53 26.33 6.96 20.26 25.69 7.52 15.44 31.66 -25.02 16.01 31.13 -26.35 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 6 3 # 6 A 10 ASP A 166 ASP.? 11.63 CL CL B 203 A 186 ASN A 168 ASN.? 18.60 CL CL B 203 A 260 ALA A 146 ALA.? 18.24 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 11.43 26.53 7.41 13.01 27.56 8.43 22.93 27.85 -26.42 21.77 26.15 -26.99 coo 21.53 26.33 6.96 20.26 25.69 7.52 15.11 31.88 -19.73 13.75 32.44 -20.04 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 7 3 # 7 A 10 ASP A 166 ASP.? 11.63 CL CL B 203 A 186 ASN B 20 ASN.? 4.66 CL CL B 203 A 260 ALA A 10 ALA^? 10.74 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 11.43 26.53 7.41 13.01 27.56 8.43 26.68 23.02 -13.35 25.29 24.43 -12.57 coo 21.53 26.33 6.96 20.26 25.69 7.52 20.51 33.12 -11.87 20.37 34.19 -12.92 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 8 3 # 8 A 10 ASP A 166 ASP.? 11.63 CL CL B 203 A 186 ASN B 20 ASN.? 4.66 CL CL B 203 A 260 ALA B 15 ALA^? 9.07 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 11.43 26.53 7.41 13.01 27.56 8.43 26.68 23.02 -13.35 25.29 24.43 -12.57 coo 21.53 26.33 6.96 20.26 25.69 7.52 33.44 29.49 -14.78 32.88 30.75 -15.46 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 9 3 # 9 A 10 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 186 ASN B 119 ASN~? 31.61 O1 SO4 B 202 A 260 ALA B 111 ALA~? 36.75 O1 SO4 B 202 coo 11.81 33.10 11.71 13.07 31.45 11.40 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 11.43 26.53 7.41 13.01 27.56 8.43 52.38 4.31 -25.10 54.19 3.61 -24.21 coo 21.53 26.33 6.96 20.26 25.69 7.52 58.44 13.32 -28.53 59.07 13.74 -27.20 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 10 3 # 10 A 10 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 186 ASN B 119 ASN~? 31.61 O1 SO4 B 202 A 260 ALA B 112 ALA~? 33.71 O2 SO4 B 202 coo 11.81 33.10 11.71 13.07 31.45 11.40 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 11.43 26.53 7.41 13.01 27.56 8.43 52.38 4.31 -25.10 54.19 3.61 -24.21 coo 21.53 26.33 6.96 20.26 25.69 7.52 54.69 12.77 -27.96 53.71 13.86 -27.54 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 11 3 # 11 A 10 ASP B 135 ASP~? 30.33 CL CL B 203 A 186 ASN B 173 ASN^? 23.36 CL CL B 203 A 260 ALA B 176 ALA^? 24.48 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 11.43 26.53 7.41 13.01 27.56 8.43 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 21.53 26.33 6.96 20.26 25.69 7.52 41.44 14.12 -26.11 39.95 13.99 -25.85 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 12 3 # 12 A 10 ASP B 158 ASP.? 18.10 CL CL B 203 A 186 ASN B 173 ASN^? 23.36 CL CL B 203 A 260 ALA B 176 ALA^? 24.48 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 11.43 26.53 7.41 13.01 27.56 8.43 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 21.53 26.33 6.96 20.26 25.69 7.52 41.44 14.12 -26.11 39.95 13.99 -25.85 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 13 3 # 13 A 10 ASP B 165 ASP.? 24.35 CL CL B 203 A 186 ASN A 20 ASN.? 21.46 O2 SO4 A 201 A 260 ALA A 15 ALA^? 15.74 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 11.43 26.53 7.41 13.01 27.56 8.43 39.64 45.42 -15.90 41.15 44.67 -17.18 coo 21.53 26.33 6.96 20.26 25.69 7.52 34.01 39.06 -17.24 34.91 37.94 -17.73 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 14 3 # 14 A 10 ASP B 165 ASP.? 24.35 CL CL B 203 A 186 ASN B 169 ASN^? 22.23 CL CL B 203 A 260 ALA A 15 ALA^? 15.74 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 11.43 26.53 7.41 13.01 27.56 8.43 41.06 37.34 -24.45 39.62 36.12 -25.46 coo 21.53 26.33 6.96 20.26 25.69 7.52 34.01 39.06 -17.24 34.91 37.94 -17.73 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 15 3 # 15 A 10 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 186 ASN B 168 ASN.? 28.30 CL CL B 203 A 260 ALA B 144 ALA~? 29.67 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 11.43 26.53 7.41 13.01 27.56 8.43 46.24 38.33 -23.56 47.43 39.28 -25.06 coo 21.53 26.33 6.96 20.26 25.69 7.52 52.84 33.66 -22.26 52.38 34.23 -23.60 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 16 3 # 16 A 10 ASP B 166 ASP.? 24.89 O2 SO4 A 201 A 186 ASN B 168 ASN.? 28.30 CL CL B 203 A 260 ALA B 146 ALA.? 28.63 CL CL B 203 coo 11.81 33.10 11.71 13.07 31.45 11.40 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 11.43 26.53 7.41 13.01 27.56 8.43 46.24 38.33 -23.56 47.43 39.28 -25.06 coo 21.53 26.33 6.96 20.26 25.69 7.52 53.17 33.58 -16.83 54.37 32.69 -17.09 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 16 hits 1r4f_c00 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 136 ASP~? 33.35 CL CL B 203 35 SER A 109 SER~? 36.36 CL CL B 203 215 ASP A 135 ASP~? 30.53 CL CL B 203 coo 11.85 17.24 72.81 11.09 15.37 72.36 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 12.20 12.71 75.45 13.69 13.84 74.03 11.05 47.60 -32.89 11.53 46.95 -35.16 coo 5.22 15.03 71.43 7.19 14.88 70.83 16.71 44.39 -33.44 18.14 42.86 -33.63 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 3 # 2 32 ASP B 136 ASP~? 35.38 CL CL B 203 35 SER B 109 SER~? 35.44 CL CL B 203 215 ASP B 135 ASP~? 30.33 CL CL B 203 coo 11.85 17.24 72.81 11.09 15.37 72.36 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 12.20 12.71 75.45 13.69 13.84 74.03 55.00 17.36 -30.57 53.91 19.30 -31.57 coo 5.22 15.03 71.43 7.19 14.88 70.83 49.61 21.30 -30.64 48.45 23.04 -30.81 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 3 3 # 3 32 ASP B 165 ASP.? 24.35 CL CL B 203 35 SER B 164 SER^? 18.68 CL CL B 203 215 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 11.85 17.24 72.81 11.09 15.37 72.36 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 12.20 12.71 75.45 13.69 13.84 74.03 42.10 35.61 -19.97 39.83 36.46 -19.54 coo 5.22 15.03 71.43 7.19 14.88 70.83 44.37 42.96 -16.74 46.40 42.79 -16.09 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 3 hits 1rne_c04 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 135 ASP~? 30.53 CL CL B 203 595 GLU A 38 GLU~? 28.10 CL CL B 203 713 TYR A 107 TYR.? 29.41 CL CL B 203 coo 5.64 2.82 38.49 4.59 4.19 37.25 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 4.35 13.73 37.63 3.39 12.18 36.55 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 3.76 10.25 31.38 3.16 9.87 34.10 12.10 46.09 -25.36 9.95 46.06 -23.57 ULMN 3 1sll_c00 SIALIDASE L user 2 3 # 2 318 ASP B 135 ASP~? 30.33 CL CL B 203 595 GLU B 38 GLU~? 33.41 CL CL B 203 713 TYR B 107 TYR.? 30.85 O4 SO4 B 202 coo 5.64 2.82 38.49 4.59 4.19 37.25 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 4.35 13.73 37.63 3.39 12.18 36.55 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 3.76 10.25 31.38 3.16 9.87 34.10 54.19 18.98 -22.56 56.19 18.89 -20.60 1sll_c00 source 1sll SIALIDASE L : 2 hits 1sll_c00 naa= 3 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP A 16 ASP^? 19.84 O2 SO4 A 201 E 168 LYS A 49 LYS~? 21.61 O2 SO4 A 201 E 201 THR A 155 THR^? 16.70 CL CL B 203 coo 5.36 16.20 22.10 3.88 17.00 23.31 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 5.06 22.32 18.11 1.02 22.08 22.74 26.03 45.00 -18.94 27.16 48.58 -22.77 coo -1.79 18.29 19.05 -1.19 20.28 19.71 32.10 37.97 -21.41 33.49 36.33 -21.72 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 2 3 # 2 E 166 ASP A 147 ASP.? 14.36 CL CL B 203 E 168 LYS A 9 LYS^? 13.80 CL CL B 203 E 201 THR A 151 THR^? 5.27 CL CL B 203 coo 5.36 16.20 22.10 3.88 17.00 23.31 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 5.06 22.32 18.11 1.02 22.08 22.74 17.34 32.48 -9.89 16.06 33.15 -4.52 coo -1.79 18.29 19.05 -1.19 20.28 19.71 23.61 29.36 -14.77 24.70 27.83 -13.70 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 3 3 # 3 E 166 ASP B 16 ASP^? 10.11 CL CL B 203 E 168 LYS B 49 LYS~? 17.28 CL CL B 203 E 201 THR B 155 THR^? 12.79 CL CL B 203 coo 5.36 16.20 22.10 3.88 17.00 23.31 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 5.06 22.32 18.11 1.02 22.08 22.74 40.33 21.93 -16.14 38.56 18.89 -19.75 coo -1.79 18.29 19.05 -1.19 20.28 19.71 35.45 29.84 -18.92 33.82 31.13 -19.55 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 4 3 # 4 E 166 ASP B 18 ASP.? 13.73 CL CL B 203 E 168 LYS B 49 LYS~? 17.28 CL CL B 203 E 201 THR B 155 THR^? 12.79 CL CL B 203 coo 5.36 16.20 22.10 3.88 17.00 23.31 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 5.06 22.32 18.11 1.02 22.08 22.74 40.33 21.93 -16.14 38.56 18.89 -19.75 coo -1.79 18.29 19.05 -1.19 20.28 19.71 35.45 29.84 -18.92 33.82 31.13 -19.55 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 5 3 # 5 E 166 ASP B 147 ASP.? 29.53 CL CL B 203 E 168 LYS B 9 LYS^? 26.01 CL CL B 203 E 201 THR B 151 THR^? 20.59 CL CL B 203 coo 5.36 16.20 22.10 3.88 17.00 23.31 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 5.06 22.32 18.11 1.02 22.08 22.74 50.82 33.22 -7.07 51.79 32.01 -1.71 coo -1.79 18.29 19.05 -1.19 20.28 19.71 45.05 37.16 -12.09 44.11 38.87 -11.18 1stc_c02 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 5 hits 1stc_c02 naa= 3 ULMN 3 1stc_c03 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP B 165 ASP.? 24.35 CL CL B 203 E 168 LYS B 167 LYS.? 28.27 O2 SO4 A 201 E 171 ASN B 168 ASN.? 28.30 CL CL B 203 coo 5.36 16.20 22.10 3.88 17.00 23.31 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 5.06 22.32 18.11 1.02 22.08 22.74 46.06 42.14 -21.13 50.44 45.35 -19.26 coo 6.68 21.78 22.39 5.28 20.74 23.60 46.24 38.33 -23.56 47.43 39.28 -25.06 1stc_c03 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 1 hits 1stc_c03 naa= 3 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 52 ASP.? 10.10 O2 SO4 A 201 255 GLU A 53 GLU.? 13.05 O2 SO4 A 201 329 ASP A 24 ASP^? 8.56 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 52.57 37.12 10.17 53.37 35.95 11.75 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 30.81 35.32 -8.62 32.08 34.13 -9.77 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP B 52 ASP.? 10.23 O4 SO4 B 202 255 GLU B 53 GLU.? 13.18 O4 SO4 B 202 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 52.57 37.12 10.17 53.37 35.95 11.75 38.06 24.56 -1.39 36.59 24.51 0.17 coo 59.16 37.82 13.95 57.63 37.03 15.12 37.06 32.38 -6.05 35.96 33.77 -7.20 1uok_c03 source 1uok OLIGO-1,6-GLUCOSIDASE : 2 hits 1uok_c03 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 16 ASP^? 19.84 O2 SO4 A 201 218 GLU A 89 GLU~? 32.07 O4 SO4 A 201 329 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 70.09 11.71 8.46 70.56 12.89 6.77 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 59.16 37.82 13.95 57.63 37.03 15.12 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 16 ASP^? 19.84 O2 SO4 A 201 218 GLU B 68 GLU.? 23.74 O4 SO4 B 202 329 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 70.09 11.71 8.46 70.56 12.89 6.77 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 59.16 37.82 13.95 57.63 37.03 15.12 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 24 ASP^? 8.56 CL CL B 203 218 GLU A 137 GLU~? 32.46 CL CL B 203 329 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 70.09 11.71 8.46 70.56 12.89 6.77 15.44 38.60 -35.89 16.74 38.72 -37.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP A 79 ASP^? 5.34 O4 SO4 A 201 218 GLU A 137 GLU~? 32.46 CL CL B 203 329 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 70.09 11.71 8.46 70.56 12.89 6.77 15.44 38.60 -35.89 16.74 38.72 -37.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP A 166 ASP.? 11.63 CL CL B 203 218 GLU B 35 GLU.? 28.14 O4 SO4 B 202 329 ASP B 158 ASP.? 18.10 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 70.09 11.71 8.46 70.56 12.89 6.77 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP B 16 ASP^? 10.11 CL CL B 203 218 GLU A 68 GLU.? 23.69 O2 SO4 A 201 329 ASP A 166 ASP.? 11.63 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 70.09 11.71 8.46 70.56 12.89 6.77 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 # 7 199 ASP B 16 ASP^? 10.11 CL CL B 203 218 GLU A 68 GLU.? 23.69 O2 SO4 A 201 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 70.09 11.71 8.46 70.56 12.89 6.77 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 8 3 # 8 199 ASP B 16 ASP^? 10.11 CL CL B 203 218 GLU B 89 GLU~? 31.72 O1 SO4 B 202 329 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 70.09 11.71 8.46 70.56 12.89 6.77 54.09 -0.06 -20.39 55.59 -1.00 -21.64 coo 59.16 37.82 13.95 57.63 37.03 15.12 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 9 3 # 9 199 ASP B 24 ASP^? 11.11 CL CL B 203 218 GLU A 35 GLU.? 23.66 CL CL B 203 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 70.09 11.71 8.46 70.56 12.89 6.77 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 10 3 # 10 199 ASP B 24 ASP^? 11.11 CL CL B 203 218 GLU A 38 GLU~? 28.10 CL CL B 203 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 70.09 11.71 8.46 70.56 12.89 6.77 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 11 3 # 11 199 ASP B 24 ASP^? 11.11 CL CL B 203 218 GLU B 137 GLU~? 34.50 CL CL B 203 329 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 49.16 35.16 15.19 51.08 34.43 15.65 37.06 32.38 -6.05 35.96 33.77 -7.20 coo 70.09 11.71 8.46 70.56 12.89 6.77 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 59.16 37.82 13.95 57.63 37.03 15.12 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 12 3 # 12 199 ASP B 52 ASP.? 10.23 O4 SO4 B 202 218 GLU A 171 GLU^? 26.34 CL CL B 203 329 ASP B 24 ASP^? 11.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 70.09 11.71 8.46 70.56 12.89 6.77 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 59.16 37.82 13.95 57.63 37.03 15.12 37.06 32.38 -6.05 35.96 33.77 -7.20 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 13 3 # 13 199 ASP B 79 ASP^? 5.64 O2 SO4 B 202 218 GLU B 137 GLU~? 34.50 CL CL B 203 329 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 49.16 35.16 15.19 51.08 34.43 15.65 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 70.09 11.71 8.46 70.56 12.89 6.77 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 59.16 37.82 13.95 57.63 37.03 15.12 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 14 3 # 14 199 ASP B 158 ASP.? 18.10 CL CL B 203 218 GLU A 35 GLU.? 23.66 CL CL B 203 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 70.09 11.71 8.46 70.56 12.89 6.77 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 15 3 # 15 199 ASP B 158 ASP.? 18.10 CL CL B 203 218 GLU A 68 GLU.? 23.69 O2 SO4 A 201 329 ASP A 166 ASP.? 11.63 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 70.09 11.71 8.46 70.56 12.89 6.77 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 16 3 # 16 199 ASP B 158 ASP.? 18.10 CL CL B 203 218 GLU A 68 GLU.? 23.69 O2 SO4 A 201 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 70.09 11.71 8.46 70.56 12.89 6.77 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 17 3 # 17 199 ASP B 166 ASP.? 24.89 O2 SO4 A 201 218 GLU B 101 GLU^? 13.49 O2 SO4 B 202 329 ASP B 147 ASP.? 29.53 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 70.09 11.71 8.46 70.56 12.89 6.77 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 52.99 37.46 -14.27 53.96 39.20 -13.53 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 17 hits 1uok_c04 naa= 3 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 16 ASP^? 19.84 O2 SO4 A 201 242 GLU A 68 GLU.? 23.69 O2 SO4 A 201 329 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 30.42 34.74 5.00 29.09 35.09 3.38 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 16 ASP^? 19.84 O2 SO4 A 201 242 GLU B 171 GLU^? 23.59 CL CL B 203 329 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 30.42 34.74 5.00 29.09 35.09 3.38 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 24 ASP^? 8.56 CL CL B 203 242 GLU B 171 GLU^? 23.59 CL CL B 203 329 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 30.81 35.32 -8.62 32.08 34.13 -9.77 coo 30.42 34.74 5.00 29.09 35.09 3.38 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP A 165 ASP.? 13.91 CL CL B 203 242 GLU A 35 GLU.? 23.66 CL CL B 203 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.42 34.74 5.00 29.09 35.09 3.38 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP A 165 ASP.? 13.91 CL CL B 203 242 GLU A 35 GLU.? 23.66 CL CL B 203 329 ASP B 18 ASP.? 13.73 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.42 34.74 5.00 29.09 35.09 3.38 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 59.16 37.82 13.95 57.63 37.03 15.12 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP A 165 ASP.? 13.91 CL CL B 203 242 GLU A 35 GLU.? 23.66 CL CL B 203 329 ASP B 158 ASP.? 18.10 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.42 34.74 5.00 29.09 35.09 3.38 8.44 41.65 -17.02 9.96 41.64 -15.52 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 7 3 # 7 199 ASP A 165 ASP.? 13.91 CL CL B 203 242 GLU A 53 GLU.? 13.05 O2 SO4 A 201 329 ASP B 158 ASP.? 18.10 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.42 34.74 5.00 29.09 35.09 3.38 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 8 3 # 8 199 ASP A 165 ASP.? 13.91 CL CL B 203 242 GLU A 68 GLU.? 23.69 O2 SO4 A 201 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.42 34.74 5.00 29.09 35.09 3.38 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 9 3 # 9 199 ASP A 165 ASP.? 13.91 CL CL B 203 242 GLU A 137 GLU~? 32.46 CL CL B 203 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.42 34.74 5.00 29.09 35.09 3.38 15.44 38.60 -35.89 16.74 38.72 -37.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 10 3 # 10 199 ASP A 165 ASP.? 13.91 CL CL B 203 242 GLU A 137 GLU~? 32.46 CL CL B 203 329 ASP B 18 ASP.? 13.73 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 30.42 34.74 5.00 29.09 35.09 3.38 15.44 38.60 -35.89 16.74 38.72 -37.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 11 3 # 11 199 ASP A 166 ASP.? 11.63 CL CL B 203 242 GLU A 38 GLU~? 28.10 CL CL B 203 329 ASP B 16 ASP^? 10.11 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 30.42 34.74 5.00 29.09 35.09 3.38 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 12 3 # 12 199 ASP A 166 ASP.? 11.63 CL CL B 203 242 GLU B 101 GLU^? 13.49 O2 SO4 B 202 329 ASP A 147 ASP.? 14.36 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 30.42 34.74 5.00 29.09 35.09 3.38 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 13 3 # 13 199 ASP B 16 ASP^? 10.11 CL CL B 203 242 GLU A 53 GLU.? 13.05 O2 SO4 A 201 329 ASP B 158 ASP.? 18.10 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 30.42 34.74 5.00 29.09 35.09 3.38 30.40 43.96 -5.99 31.90 43.40 -4.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 14 3 # 14 199 ASP B 16 ASP^? 10.11 CL CL B 203 242 GLU A 171 GLU^? 26.34 CL CL B 203 329 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 30.42 34.74 5.00 29.09 35.09 3.38 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 59.16 37.82 13.95 57.63 37.03 15.12 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 15 3 # 15 199 ASP B 16 ASP^? 10.11 CL CL B 203 242 GLU B 68 GLU.? 23.74 O4 SO4 B 202 329 ASP A 165 ASP.? 13.91 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 30.42 34.74 5.00 29.09 35.09 3.38 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 59.16 37.82 13.95 57.63 37.03 15.12 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 16 3 # 16 199 ASP B 16 ASP^? 10.11 CL CL B 203 242 GLU B 68 GLU.? 23.74 O4 SO4 B 202 329 ASP A 166 ASP.? 11.63 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 30.42 34.74 5.00 29.09 35.09 3.38 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 59.16 37.82 13.95 57.63 37.03 15.12 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 17 3 # 17 199 ASP B 16 ASP^? 10.11 CL CL B 203 242 GLU B 83 GLU^? 22.50 O1 SO4 B 202 329 ASP A 166 ASP.? 11.63 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 30.42 34.74 5.00 29.09 35.09 3.38 51.81 11.56 -14.99 53.08 11.18 -13.32 coo 59.16 37.82 13.95 57.63 37.03 15.12 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 18 3 # 18 199 ASP B 18 ASP.? 13.73 CL CL B 203 242 GLU B 68 GLU.? 23.74 O4 SO4 B 202 329 ASP A 165 ASP.? 13.91 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 30.42 34.74 5.00 29.09 35.09 3.38 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 59.16 37.82 13.95 57.63 37.03 15.12 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 19 3 # 19 199 ASP B 158 ASP.? 18.10 CL CL B 203 242 GLU B 137 GLU~? 34.50 CL CL B 203 329 ASP A 165 ASP.? 13.91 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 30.42 34.74 5.00 29.09 35.09 3.38 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 59.16 37.82 13.95 57.63 37.03 15.12 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 20 3 # 20 199 ASP B 158 ASP.? 18.10 CL CL B 203 242 GLU B 137 GLU~? 34.50 CL CL B 203 329 ASP A 166 ASP.? 11.63 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 30.42 34.74 5.00 29.09 35.09 3.38 51.72 26.55 -33.23 50.47 26.22 -34.95 coo 59.16 37.82 13.95 57.63 37.03 15.12 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 21 3 # 21 199 ASP B 166 ASP.? 24.89 O2 SO4 A 201 242 GLU A 171 GLU^? 26.34 CL CL B 203 329 ASP B 147 ASP.? 29.53 CL CL B 203 coo 49.16 35.16 15.19 51.08 34.43 15.65 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 30.42 34.74 5.00 29.09 35.09 3.38 28.18 38.40 -30.98 29.16 38.58 -32.86 coo 59.16 37.82 13.95 57.63 37.03 15.12 52.99 37.46 -14.27 53.96 39.20 -13.53 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 22 3 # 22 199 ASP B 166 ASP.? 24.89 O2 SO4 A 201 242 GLU B 38 GLU~? 33.41 CL CL B 203 329 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 30.42 34.74 5.00 29.09 35.09 3.38 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 23 3 # 23 199 ASP B 166 ASP.? 24.89 O2 SO4 A 201 242 GLU B 38 GLU~? 33.41 CL CL B 203 329 ASP A 18 ASP.? 23.99 O2 SO4 A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 30.42 34.74 5.00 29.09 35.09 3.38 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 59.16 37.82 13.95 57.63 37.03 15.12 35.31 47.04 -22.18 34.84 45.98 -23.97 1uok_c05 source 1uok OLIGO-1,6-GLUCOSIDASE : 23 hits 1uok_c05 naa= 3 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 # 1 A 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 596 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 69.13 32.20 28.58 68.39 32.96 30.44 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 70.89 37.31 29.70 69.54 36.29 32.39 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 66.09 40.54 34.70 66.92 37.69 35.49 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 2 3 # 2 A 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 A 596 ARG A 43 ARG~? 21.16 CL CL B 203 A 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 69.13 32.20 28.58 68.39 32.96 30.44 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 70.89 37.31 29.70 69.54 36.29 32.39 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 66.09 40.54 34.70 66.92 37.69 35.49 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 3 3 # 3 A 581 GLU A 89 GLU~? 32.07 O4 SO4 A 201 A 596 ARG A 90 ARG~? 30.13 O3 SO4 A 201 A 647 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo 69.13 32.20 28.58 68.39 32.96 30.44 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 70.89 37.31 29.70 69.54 36.29 32.39 5.35 65.69 -16.45 4.68 68.72 -16.26 coo 66.09 40.54 34.70 66.92 37.69 35.49 9.44 57.19 -15.50 10.34 55.43 -13.15 1v0e_c00 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c00 naa= 3 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 # 1 B 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 B 596 ARG A 39 ARG~? 27.60 O2 SO4 A 201 B 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 38.22 57.83 70.36 36.82 56.74 69.18 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 34.24 60.89 68.08 33.31 57.93 67.63 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 31.43 57.38 61.97 31.90 55.58 64.41 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 2 3 # 2 B 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 B 596 ARG A 43 ARG~? 21.16 CL CL B 203 B 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 38.22 57.83 70.36 36.82 56.74 69.18 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 34.24 60.89 68.08 33.31 57.93 67.63 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 31.43 57.38 61.97 31.90 55.58 64.41 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 3 3 # 3 B 581 GLU A 89 GLU~? 32.07 O4 SO4 A 201 B 596 ARG A 90 ARG~? 30.13 O3 SO4 A 201 B 647 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo 38.22 57.83 70.36 36.82 56.74 69.18 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 34.24 60.89 68.08 33.31 57.93 67.63 5.35 65.69 -16.45 4.68 68.72 -16.26 coo 31.43 57.38 61.97 31.90 55.58 64.41 9.44 57.19 -15.50 10.34 55.43 -13.15 1v0e_c01 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c01 naa= 3 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 # 1 C 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 C 596 ARG A 39 ARG~? 27.60 O2 SO4 A 201 C 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 11.31 31.26 27.00 13.31 30.71 26.58 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 13.44 32.78 22.07 15.56 30.91 23.37 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 21.00 33.35 22.82 19.83 30.82 24.09 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 2 3 # 2 C 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 C 596 ARG A 43 ARG~? 21.16 CL CL B 203 C 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 11.31 31.26 27.00 13.31 30.71 26.58 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 13.44 32.78 22.07 15.56 30.91 23.37 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 21.00 33.35 22.82 19.83 30.82 24.09 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 3 3 # 3 C 581 GLU A 89 GLU~? 32.07 O4 SO4 A 201 C 596 ARG A 90 ARG~? 30.13 O3 SO4 A 201 C 647 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo 11.31 31.26 27.00 13.31 30.71 26.58 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 13.44 32.78 22.07 15.56 30.91 23.37 5.35 65.69 -16.45 4.68 68.72 -16.26 coo 21.00 33.35 22.82 19.83 30.82 24.09 9.44 57.19 -15.50 10.34 55.43 -13.15 1v0e_c02 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c02 naa= 3 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 # 1 D 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 D 596 ARG A 39 ARG~? 27.60 O2 SO4 A 201 D 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 13.06 47.55 -15.25 11.61 49.09 -15.60 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 2 3 # 2 D 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 D 596 ARG A 43 ARG~? 21.16 CL CL B 203 D 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 13.06 47.55 -15.25 11.61 49.09 -15.60 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 3 3 # 3 D 581 GLU A 89 GLU~? 32.07 O4 SO4 A 201 D 596 ARG A 90 ARG~? 30.13 O3 SO4 A 201 D 647 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 7.10 64.61 -22.00 6.35 64.00 -23.92 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 5.35 65.69 -16.45 4.68 68.72 -16.26 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 9.44 57.19 -15.50 10.34 55.43 -13.15 1v0e_c03 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c03 naa= 3 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 # 1 E 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 E 596 ARG A 39 ARG~? 27.60 O2 SO4 A 201 E 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 2 3 # 2 E 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 E 596 ARG A 43 ARG~? 21.16 CL CL B 203 E 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 13.06 47.55 -15.25 11.61 49.09 -15.60 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 3 3 # 3 E 581 GLU A 89 GLU~? 32.07 O4 SO4 A 201 E 596 ARG A 90 ARG~? 30.13 O3 SO4 A 201 E 647 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 5.35 65.69 -16.45 4.68 68.72 -16.26 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 9.44 57.19 -15.50 10.34 55.43 -13.15 1v0e_c04 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c04 naa= 3 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 # 1 F 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 F 596 ARG A 39 ARG~? 27.60 O2 SO4 A 201 F 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 13.06 47.55 -15.25 11.61 49.09 -15.60 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 2 3 # 2 F 581 GLU A 68 GLU.? 23.69 O2 SO4 A 201 F 596 ARG A 43 ARG~? 21.16 CL CL B 203 F 647 ARG A 31 ARG^? 24.05 CL CL B 203 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 13.06 47.55 -15.25 11.61 49.09 -15.60 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 3 3 # 3 F 581 GLU A 89 GLU~? 32.07 O4 SO4 A 201 F 596 ARG A 90 ARG~? 30.13 O3 SO4 A 201 F 647 ARG A 91 ARG~? 21.95 O3 SO4 A 201 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 7.10 64.61 -22.00 6.35 64.00 -23.92 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 5.35 65.69 -16.45 4.68 68.72 -16.26 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 9.44 57.19 -15.50 10.34 55.43 -13.15 1v0e_c05 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c05 naa= 3 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 A 100 PHE A 126 PHE.? 22.45 O4 SO4 A 201 A 197 ASN A 128 ASN.? 15.88 O4 SO4 A 201 A 198 PRO A 180 PRO.? 18.92 O4 SO4 A 201 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 17.68 64.47 -20.11 15.06 65.33 -19.53 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 23.73 62.15 -16.98 21.71 62.36 -16.27 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 26.29 59.45 -21.14 26.78 60.27 -23.19 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 2 3 # 2 A 100 PHE B 126 PHE.? 22.81 O1 SO4 B 202 A 197 ASN B 128 ASN.? 16.24 O2 SO4 B 202 A 198 PRO B 180 PRO.? 19.03 O2 SO4 B 202 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 46.15 1.60 -17.22 48.54 0.22 -16.67 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 40.54 4.79 -14.04 42.49 4.20 -13.37 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 37.50 8.10 -18.33 37.92 6.87 -20.17 1vq1_c00 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 2 hits 1vq1_c00 naa= 3 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 B 100 PHE A 126 PHE.? 22.45 O4 SO4 A 201 B 197 ASN A 128 ASN.? 15.88 O4 SO4 A 201 B 198 PRO A 180 PRO.? 18.92 O4 SO4 A 201 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 17.68 64.47 -20.11 15.06 65.33 -19.53 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 23.73 62.15 -16.98 21.71 62.36 -16.27 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 26.29 59.45 -21.14 26.78 60.27 -23.19 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 2 3 # 2 B 100 PHE B 126 PHE.? 22.81 O1 SO4 B 202 B 197 ASN B 128 ASN.? 16.24 O2 SO4 B 202 B 198 PRO B 180 PRO.? 19.03 O2 SO4 B 202 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 46.15 1.60 -17.22 48.54 0.22 -16.67 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 40.54 4.79 -14.04 42.49 4.20 -13.37 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 37.50 8.10 -18.33 37.92 6.87 -20.17 1vq1_c01 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 2 hits 1vq1_c01 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 107 TYR.? 29.41 CL CL B 203 A 317 GLU A 38 GLU~? 28.10 CL CL B 203 A 365 ARG A 110 ARG~? 42.02 CL CL B 203 coo 1.77 6.56 57.05 3.05 7.44 59.37 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 3.06 2.85 52.79 4.83 3.89 53.24 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 3.82 17.09 49.56 4.09 14.32 50.84 3.93 48.32 -34.88 2.67 46.51 -37.04 ULMN 3 1vzx_c02 2.04.01.0087 user 2 3 # 2 A 314 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 317 GLU B 101 GLU^? 13.49 O2 SO4 B 202 A 365 ARG B 54 ARG.? 5.08 O4 SO4 B 202 coo 1.77 6.56 57.05 3.05 7.44 59.37 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 3.06 2.85 52.79 4.83 3.89 53.24 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 3.82 17.09 49.56 4.09 14.32 50.84 37.77 18.62 -0.73 37.02 15.96 0.60 ULMN 3 1vzx_c02 2.04.01.0087 user 3 3 # 3 A 314 TYR B 107 TYR.? 30.85 O4 SO4 B 202 A 317 GLU B 38 GLU~? 33.41 CL CL B 203 A 365 ARG B 110 ARG~? 44.21 CL CL B 203 coo 1.77 6.56 57.05 3.05 7.44 59.37 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 3.06 2.85 52.79 4.83 3.89 53.24 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 3.82 17.09 49.56 4.09 14.32 50.84 60.95 18.14 -32.42 62.40 18.76 -35.07 1vzx_c02 source 1vzx 2.04.01.0087 : 3 hits 1vzx_c02 naa= 3 ULMN 3 1vzx_c03 2.04.01.0087 user 1 3 # 1 B1314 TYR A 107 TYR.? 29.41 CL CL B 203 B1317 GLU A 38 GLU~? 28.10 CL CL B 203 B1365 ARG A 110 ARG~? 42.02 CL CL B 203 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 10.35 38.63 -25.29 9.73 39.61 -27.07 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 3.93 48.32 -34.88 2.67 46.51 -37.04 ULMN 3 1vzx_c03 2.04.01.0087 user 2 3 # 2 B1314 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B1317 GLU B 101 GLU^? 13.49 O2 SO4 B 202 B1365 ARG B 54 ARG.? 5.08 O4 SO4 B 202 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 37.77 18.62 -0.73 37.02 15.96 0.60 ULMN 3 1vzx_c03 2.04.01.0087 user 3 3 # 3 B1314 TYR B 107 TYR.? 30.85 O4 SO4 B 202 B1317 GLU B 38 GLU~? 33.41 CL CL B 203 B1365 ARG B 110 ARG~? 44.21 CL CL B 203 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 56.16 26.15 -22.68 57.22 25.29 -24.33 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 60.95 18.14 -32.42 62.40 18.76 -35.07 1vzx_c03 source 1vzx 2.04.01.0087 : 3 hits 1vzx_c03 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 40 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 103 LEU A 48 LEU~? 15.56 CL CL B 203 coo 12.09 16.13 10.57 11.28 18.80 10.73 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 7.55 25.51 14.34 9.65 25.73 14.24 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 11.83 18.73 16.99 10.99 19.71 15.26 24.81 40.79 -17.90 24.31 38.70 -17.46 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 A 40 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 103 LEU A 55 LEU^? 13.94 O2 SO4 A 201 coo 12.09 16.13 10.57 11.28 18.80 10.73 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 7.55 25.51 14.34 9.65 25.73 14.24 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 11.83 18.73 16.99 10.99 19.71 15.26 23.87 46.83 -9.98 22.81 47.53 -11.77 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR A 107 TYR.? 29.41 CL CL B 203 A 40 ASP A 135 ASP~? 30.53 CL CL B 203 A 103 LEU A 139 LEU~? 26.71 CL CL B 203 coo 12.09 16.13 10.57 11.28 18.80 10.73 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 7.55 25.51 14.34 9.65 25.73 14.24 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 11.83 18.73 16.99 10.99 19.71 15.26 14.50 41.00 -28.04 13.48 41.98 -26.40 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR A 133 TYR^? 32.81 O4 SO4 A 201 A 40 ASP A 136 ASP~? 33.35 CL CL B 203 A 103 LEU A 134 LEU.? 26.36 CL CL B 203 coo 12.09 16.13 10.57 11.28 18.80 10.73 17.01 49.27 -30.66 15.25 47.83 -32.31 coo 7.55 25.51 14.34 9.65 25.73 14.24 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 11.83 18.73 16.99 10.99 19.71 15.26 18.11 44.77 -27.67 19.05 42.82 -27.40 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 5 3 # 5 A 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 40 ASP B 16 ASP^? 10.11 CL CL B 203 A 103 LEU B 48 LEU~? 16.07 CL CL B 203 coo 12.09 16.13 10.57 11.28 18.80 10.73 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 7.55 25.51 14.34 9.65 25.73 14.24 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 11.83 18.73 16.99 10.99 19.71 15.26 42.05 25.99 -15.26 42.80 28.02 -14.89 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 6 3 # 6 A 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 A 40 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 103 LEU B 55 LEU.? 14.27 O4 SO4 B 202 coo 12.09 16.13 10.57 11.28 18.80 10.73 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 7.55 25.51 14.34 9.65 25.73 14.24 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 11.83 18.73 16.99 10.99 19.71 15.26 42.41 20.13 -7.17 43.34 19.25 -8.99 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 7 3 # 7 A 16 TYR B 107 TYR.? 30.85 O4 SO4 B 202 A 40 ASP B 135 ASP~? 30.33 CL CL B 203 A 103 LEU B 139 LEU~? 29.79 CL CL B 203 coo 12.09 16.13 10.57 11.28 18.80 10.73 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 7.55 25.51 14.34 9.65 25.73 14.24 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 11.83 18.73 16.99 10.99 19.71 15.26 52.36 24.38 -25.29 53.36 23.29 -23.69 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 7 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 B 40 ASP A 16 ASP^? 19.84 O2 SO4 A 201 B 103 LEU A 48 LEU~? 15.56 CL CL B 203 coo 14.25 20.09 37.35 13.48 17.40 37.38 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 9.39 10.77 34.53 11.50 10.63 34.41 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 12.89 17.60 31.13 12.34 16.51 32.90 24.81 40.79 -17.90 24.31 38.70 -17.46 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 50 TYR~? 16.99 O2 SO4 A 201 B 40 ASP A 79 ASP^? 5.34 O4 SO4 A 201 B 103 LEU A 55 LEU^? 13.94 O2 SO4 A 201 coo 14.25 20.09 37.35 13.48 17.40 37.38 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 9.39 10.77 34.53 11.50 10.63 34.41 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 12.89 17.60 31.13 12.34 16.51 32.90 23.87 46.83 -9.98 22.81 47.53 -11.77 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR A 107 TYR.? 29.41 CL CL B 203 B 40 ASP A 135 ASP~? 30.53 CL CL B 203 B 103 LEU A 139 LEU~? 26.71 CL CL B 203 coo 14.25 20.09 37.35 13.48 17.40 37.38 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 9.39 10.77 34.53 11.50 10.63 34.41 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 12.89 17.60 31.13 12.34 16.51 32.90 14.50 41.00 -28.04 13.48 41.98 -26.40 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR A 107 TYR.? 29.41 CL CL B 203 B 40 ASP A 136 ASP~? 33.35 CL CL B 203 B 103 LEU A 134 LEU.? 26.36 CL CL B 203 coo 14.25 20.09 37.35 13.48 17.40 37.38 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 9.39 10.77 34.53 11.50 10.63 34.41 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 12.89 17.60 31.13 12.34 16.51 32.90 18.11 44.77 -27.67 19.05 42.82 -27.40 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 5 3 # 5 B 16 TYR A 133 TYR^? 32.81 O4 SO4 A 201 B 40 ASP A 136 ASP~? 33.35 CL CL B 203 B 103 LEU A 134 LEU.? 26.36 CL CL B 203 coo 14.25 20.09 37.35 13.48 17.40 37.38 17.01 49.27 -30.66 15.25 47.83 -32.31 coo 9.39 10.77 34.53 11.50 10.63 34.41 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 12.89 17.60 31.13 12.34 16.51 32.90 18.11 44.77 -27.67 19.05 42.82 -27.40 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 6 3 # 6 B 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B 40 ASP B 16 ASP^? 10.11 CL CL B 203 B 103 LEU B 48 LEU~? 16.07 CL CL B 203 coo 14.25 20.09 37.35 13.48 17.40 37.38 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 9.39 10.77 34.53 11.50 10.63 34.41 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 12.89 17.60 31.13 12.34 16.51 32.90 42.05 25.99 -15.26 42.80 28.02 -14.89 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 7 3 # 7 B 16 TYR B 50 TYR~? 17.17 O4 SO4 B 202 B 40 ASP B 79 ASP^? 5.64 O2 SO4 B 202 B 103 LEU B 55 LEU.? 14.27 O4 SO4 B 202 coo 14.25 20.09 37.35 13.48 17.40 37.38 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 9.39 10.77 34.53 11.50 10.63 34.41 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 12.89 17.60 31.13 12.34 16.51 32.90 42.41 20.13 -7.17 43.34 19.25 -8.99 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 8 3 # 8 B 16 TYR B 107 TYR.? 30.85 O4 SO4 B 202 B 40 ASP B 135 ASP~? 30.33 CL CL B 203 B 103 LEU B 139 LEU~? 29.79 CL CL B 203 coo 14.25 20.09 37.35 13.48 17.40 37.38 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 9.39 10.77 34.53 11.50 10.63 34.41 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 12.89 17.60 31.13 12.34 16.51 32.90 52.36 24.38 -25.29 53.36 23.29 -23.69 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 9 3 # 9 B 16 TYR B 133 TYR^? 31.17 CL CL B 203 B 40 ASP B 136 ASP~? 35.38 CL CL B 203 B 103 LEU B 134 LEU.? 26.22 CL CL B 203 coo 14.25 20.09 37.35 13.48 17.40 37.38 48.83 16.45 -27.74 50.79 17.58 -29.40 coo 9.39 10.77 34.53 11.50 10.63 34.41 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 12.89 17.60 31.13 12.34 16.51 32.90 48.44 21.19 -24.90 47.63 23.22 -24.70 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 9 hits 1vzz_c01 naa= 3 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 1 3 # 1 A 105 HIS A 75 HIS.? -3.80 O3 SO4 A 201s A 169 ASP A 79 ASP^? 5.34 O4 SO4 A 201 A 288 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo 67.72 35.99 30.87 69.77 36.13 31.33 27.80 60.20 0.72 29.73 60.52 1.48 coo 73.17 30.66 22.56 72.87 30.30 20.46 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 74.06 28.51 15.92 73.77 29.56 17.73 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 2 3 # 2 A 105 HIS B 75 HIS.? -3.77 O1 SO4 B 202s A 169 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 288 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo 67.72 35.99 30.87 69.77 36.13 31.33 36.52 7.25 3.52 34.54 7.26 4.22 coo 73.17 30.66 22.56 72.87 30.30 20.46 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 74.06 28.51 15.92 73.77 29.56 17.73 39.44 10.40 -13.31 37.47 11.26 -13.58 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 2 hits 1w1o_c00 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 30 ALA^? 21.24 CL CL B 203 B 126 ARG A 148 ARG.? 18.96 CL CL B 203 B 138 GLU A 35 GLU.? 23.66 CL CL B 203 coo 2.11 4.00 19.31 3.14 4.86 19.99 10.56 38.47 -9.51 10.10 39.20 -8.26 coo 2.45 5.53 11.28 3.59 7.56 13.29 10.63 29.23 -12.53 8.60 28.94 -10.24 coo 6.10 2.00 25.24 6.12 1.84 23.13 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 B 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 B 138 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 2.11 4.00 19.31 3.14 4.86 19.99 17.39 48.54 -11.26 18.35 47.55 -11.93 coo 2.45 5.53 11.28 3.59 7.56 13.29 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 6.10 2.00 25.24 6.12 1.84 23.13 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 B 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 B 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 B 138 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo 2.11 4.00 19.31 3.14 4.86 19.99 17.39 48.54 -11.26 18.35 47.55 -11.93 coo 2.45 5.53 11.28 3.59 7.56 13.29 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 6.10 2.00 25.24 6.12 1.84 23.13 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 B 124 ALA A 99 ALA^? 13.12 O3 SO4 A 201 B 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 B 138 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo 2.11 4.00 19.31 3.14 4.86 19.99 20.60 59.87 -10.95 20.15 58.58 -11.64 coo 2.45 5.53 11.28 3.59 7.56 13.29 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 6.10 2.00 25.24 6.12 1.84 23.13 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 B 124 ALA B 69 ALA^? 17.45 O4 SO4 B 202 B 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 B 138 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo 2.11 4.00 19.31 3.14 4.86 19.99 48.48 17.48 -8.39 47.65 18.57 -9.03 coo 2.45 5.53 11.28 3.59 7.56 13.29 45.42 12.48 -0.13 47.39 14.66 0.83 coo 6.10 2.00 25.24 6.12 1.84 23.13 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 B 124 ALA B 99 ALA^? 13.03 O1 SO4 B 202 B 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 B 138 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo 2.11 4.00 19.31 3.14 4.86 19.99 43.79 6.64 -8.02 44.39 7.81 -8.78 coo 2.45 5.53 11.28 3.59 7.56 13.29 45.42 12.48 -0.13 47.39 14.66 0.83 coo 6.10 2.00 25.24 6.12 1.84 23.13 39.44 10.40 -13.31 37.47 11.26 -13.58 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 30 ALA^? 21.24 CL CL B 203 C 126 ARG A 148 ARG.? 18.96 CL CL B 203 C 138 GLU A 35 GLU.? 23.66 CL CL B 203 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 10.56 38.47 -9.51 10.10 39.20 -8.26 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 10.63 29.23 -12.53 8.60 28.94 -10.24 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 C 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 C 138 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 17.39 48.54 -11.26 18.35 47.55 -11.93 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 C 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 C 138 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 17.39 48.54 -11.26 18.35 47.55 -11.93 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 C 124 ALA A 99 ALA^? 13.12 O3 SO4 A 201 C 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 C 138 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 20.60 59.87 -10.95 20.15 58.58 -11.64 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 C 124 ALA B 69 ALA^? 17.45 O4 SO4 B 202 C 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 C 138 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 48.48 17.48 -8.39 47.65 18.57 -9.03 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 45.42 12.48 -0.13 47.39 14.66 0.83 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 C 124 ALA B 99 ALA^? 13.03 O1 SO4 B 202 C 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 C 138 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 43.79 6.64 -8.02 44.39 7.81 -8.78 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 45.42 12.48 -0.13 47.39 14.66 0.83 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 39.44 10.40 -13.31 37.47 11.26 -13.58 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 30 ALA^? 21.24 CL CL B 203 D 126 ARG A 148 ARG.? 18.96 CL CL B 203 D 138 GLU A 35 GLU.? 23.66 CL CL B 203 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 10.56 38.47 -9.51 10.10 39.20 -8.26 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 10.63 29.23 -12.53 8.60 28.94 -10.24 coo 6.23 0.50 57.10 5.93 0.72 59.19 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 D 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 D 138 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 17.39 48.54 -11.26 18.35 47.55 -11.93 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 6.23 0.50 57.10 5.93 0.72 59.19 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 D 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 D 138 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 17.39 48.54 -11.26 18.35 47.55 -11.93 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 6.23 0.50 57.10 5.93 0.72 59.19 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 D 124 ALA A 99 ALA^? 13.12 O3 SO4 A 201 D 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 D 138 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 20.60 59.87 -10.95 20.15 58.58 -11.64 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 19.61 53.07 -4.13 17.97 51.61 -1.95 coo 6.23 0.50 57.10 5.93 0.72 59.19 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 D 124 ALA B 99 ALA^? 13.03 O1 SO4 B 202 D 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 D 138 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 43.79 6.64 -8.02 44.39 7.81 -8.78 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 45.42 12.48 -0.13 47.39 14.66 0.83 coo 6.23 0.50 57.10 5.93 0.72 59.19 39.44 10.40 -13.31 37.47 11.26 -13.58 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 5 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 30 ALA^? 21.24 CL CL B 203 E 126 ARG A 148 ARG.? 18.96 CL CL B 203 E 138 GLU A 35 GLU.? 23.66 CL CL B 203 coo -4.56 10.03 62.36 -4.38 11.31 61.55 10.56 38.47 -9.51 10.10 39.20 -8.26 coo -3.02 12.00 70.07 -1.94 13.84 67.82 10.63 29.23 -12.53 8.60 28.94 -10.24 coo -8.67 12.22 56.54 -8.68 12.09 58.65 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 E 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 E 138 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo -4.56 10.03 62.36 -4.38 11.31 61.55 17.39 48.54 -11.26 18.35 47.55 -11.93 coo -3.02 12.00 70.07 -1.94 13.84 67.82 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -8.67 12.22 56.54 -8.68 12.09 58.65 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 E 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 E 138 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo -4.56 10.03 62.36 -4.38 11.31 61.55 17.39 48.54 -11.26 18.35 47.55 -11.93 coo -3.02 12.00 70.07 -1.94 13.84 67.82 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -8.67 12.22 56.54 -8.68 12.09 58.65 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 E 124 ALA A 99 ALA^? 13.12 O3 SO4 A 201 E 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 E 138 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo -4.56 10.03 62.36 -4.38 11.31 61.55 20.60 59.87 -10.95 20.15 58.58 -11.64 coo -3.02 12.00 70.07 -1.94 13.84 67.82 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -8.67 12.22 56.54 -8.68 12.09 58.65 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 E 124 ALA B 51 ALA.? 11.87 CL CL B 203 E 126 ARG B 19 ARG.? 10.93 CL CL B 203 E 138 GLU B 53 GLU.? 13.18 O4 SO4 B 202 coo -4.56 10.03 62.36 -4.38 11.31 61.55 39.36 22.85 -10.60 38.84 24.20 -11.02 coo -3.02 12.00 70.07 -1.94 13.84 67.82 34.18 19.86 -14.65 35.93 20.77 -12.27 coo -8.67 12.22 56.54 -8.68 12.09 58.65 38.06 24.56 -1.39 36.59 24.51 0.17 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 E 124 ALA B 99 ALA^? 13.03 O1 SO4 B 202 E 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 E 138 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo -4.56 10.03 62.36 -4.38 11.31 61.55 43.79 6.64 -8.02 44.39 7.81 -8.78 coo -3.02 12.00 70.07 -1.94 13.84 67.82 45.42 12.48 -0.13 47.39 14.66 0.83 coo -8.67 12.22 56.54 -8.68 12.09 58.65 39.44 10.40 -13.31 37.47 11.26 -13.58 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 30 ALA^? 21.24 CL CL B 203 F 126 ARG A 148 ARG.? 18.96 CL CL B 203 F 138 GLU A 35 GLU.? 23.66 CL CL B 203 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 10.56 38.47 -9.51 10.10 39.20 -8.26 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 10.63 29.23 -12.53 8.60 28.94 -10.24 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 F 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 F 138 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 17.39 48.54 -11.26 18.35 47.55 -11.93 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 13.06 47.55 -15.25 11.61 49.09 -15.60 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA A 69 ALA^? 17.30 O2 SO4 A 201 F 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 F 138 GLU A 83 GLU^? 22.48 O3 SO4 A 201 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 17.39 48.54 -11.26 18.35 47.55 -11.93 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 13.33 53.63 -17.82 12.09 54.13 -16.20 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 F 124 ALA A 99 ALA^? 13.12 O3 SO4 A 201 F 126 ARG A 72 ARG^? 12.89 O3 SO4 A 201 F 138 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 20.60 59.87 -10.95 20.15 58.58 -11.64 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 19.61 53.07 -4.13 17.97 51.61 -1.95 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 F 124 ALA B 69 ALA^? 17.45 O4 SO4 B 202 F 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 F 138 GLU B 68 GLU.? 23.74 O4 SO4 B 202 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 48.48 17.48 -8.39 47.65 18.57 -9.03 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 45.42 12.48 -0.13 47.39 14.66 0.83 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 52.13 16.66 -12.75 54.11 15.89 -12.66 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 F 124 ALA B 99 ALA^? 13.03 O1 SO4 B 202 F 126 ARG B 72 ARG^? 12.97 O1 SO4 B 202 F 138 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 43.79 6.64 -8.02 44.39 7.81 -8.78 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 45.42 12.48 -0.13 47.39 14.66 0.83 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 39.44 10.40 -13.31 37.47 11.26 -13.58 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c11 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY A 159 GLY.? 25.91 O2 SO4 A 201 B 175 ARG A 19 ARG.? 15.12 O2 SO4 A 201 B 242 TYR A 50 TYR~? 16.99 O2 SO4 A 201 coo 99.45 58.28 3.33 99.57 58.61 4.10 30.87 46.49 -26.78 31.14 45.74 -26.87 coo 106.37 63.53 0.89 108.02 63.40 -1.62 32.30 48.48 -17.38 30.29 47.61 -15.22 coo 100.93 69.04 4.38 99.52 68.48 2.09 25.15 49.16 -16.65 24.90 50.91 -18.81 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 # 2 B 137 GLY B 159 GLY.? 17.44 CL CL B 203 B 175 ARG B 19 ARG.? 10.93 CL CL B 203 B 242 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo 99.45 58.28 3.33 99.57 58.61 4.10 36.00 21.20 -23.35 35.77 21.93 -23.63 coo 106.37 63.53 0.89 108.02 63.40 -1.62 34.18 19.86 -14.65 35.93 20.77 -12.27 coo 100.93 69.04 4.38 99.52 68.48 2.09 40.69 17.69 -13.90 40.63 15.92 -16.06 1xva_c03 source 1xva GLYCINE N-METHYLTRANSFERASE : 2 hits 1xva_c03 naa= 3 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP A 147 ASP.? 14.36 CL CL B 203 A 371 LYS A 9 LYS^? 13.80 CL CL B 203 A 407 THR A 151 THR^? 5.27 CL CL B 203 coo -5.17 31.09 15.73 -7.07 31.12 16.73 16.08 28.22 -17.17 15.39 26.23 -17.08 coo -4.43 30.92 22.89 -6.61 31.91 19.71 17.34 32.48 -9.89 16.06 33.15 -4.52 coo -8.38 36.02 19.06 -8.83 34.10 19.89 23.61 29.36 -14.77 24.70 27.83 -13.70 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 2 3 # 2 A 369 ASP B 147 ASP.? 29.53 CL CL B 203 A 371 LYS B 9 LYS^? 26.01 CL CL B 203 A 407 THR B 151 THR^? 20.59 CL CL B 203 coo -5.17 31.09 15.73 -7.07 31.12 16.73 52.99 37.46 -14.27 53.96 39.20 -13.53 coo -4.43 30.92 22.89 -6.61 31.91 19.71 50.82 33.22 -7.07 51.79 32.01 -1.71 coo -8.38 36.02 19.06 -8.83 34.10 19.89 45.05 37.16 -12.09 44.11 38.87 -11.18 1zrz_c02 source 1zrz PROTEIN KINASE C, IOTA : 2 hits 1zrz_c02 naa= 3 ULMN 3 1zrz_c03 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP B 165 ASP.? 24.35 CL CL B 203 A 371 LYS B 167 LYS.? 28.27 O2 SO4 A 201 A 374 ASN B 168 ASN.? 28.30 CL CL B 203 coo -5.17 31.09 15.73 -7.07 31.12 16.73 45.25 37.97 -17.38 46.58 38.45 -18.99 coo -4.43 30.92 22.89 -6.61 31.91 19.71 46.06 42.14 -21.13 50.44 45.35 -19.26 coo -4.84 27.04 20.49 -6.40 27.76 19.26 46.24 38.33 -23.56 47.43 39.28 -25.06 1zrz_c03 source 1zrz PROTEIN KINASE C, IOTA : 1 hits 1zrz_c03 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 47 TRP~? 16.38 CL CL B 203 223 ASP A 52 ASP.? 10.10 O2 SO4 A 201 258 ALA A 15 ALA^? 15.74 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 21.59 43.66 -11.80 24.90 41.61 -11.24 coo 127.91 41.73 23.55 129.18 40.35 24.44 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 141.00 37.49 25.74 139.80 37.53 24.78 34.01 39.06 -17.24 34.91 37.94 -17.73 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP A 47 TRP~? 16.38 CL CL B 203 223 ASP A 52 ASP.? 10.10 O2 SO4 A 201 258 ALA A 103 ALA^? 18.27 O4 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 21.59 43.66 -11.80 24.90 41.61 -11.24 coo 127.91 41.73 23.55 129.18 40.35 24.44 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 141.00 37.49 25.74 139.80 37.53 24.78 20.86 53.82 -18.94 21.82 52.66 -18.69 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 3 3 # 3 142 TRP A 47 TRP~? 16.38 CL CL B 203 223 ASP A 52 ASP.? 10.10 O2 SO4 A 201 258 ALA A 154 ALA^? 14.81 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 21.59 43.66 -11.80 24.90 41.61 -11.24 coo 127.91 41.73 23.55 129.18 40.35 24.44 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 141.00 37.49 25.74 139.80 37.53 24.78 28.91 36.74 -19.76 27.90 37.81 -19.35 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 4 3 # 4 142 TRP A 70 TRP^? 14.31 O3 SO4 A 201 223 ASP A 52 ASP.? 10.10 O2 SO4 A 201 258 ALA A 100 ALA^? 9.11 O4 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 18.20 50.70 -6.77 15.49 53.36 -5.69 coo 127.91 41.73 23.55 129.18 40.35 24.44 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 141.00 37.49 25.74 139.80 37.53 24.78 24.23 60.53 -11.81 25.41 60.02 -11.04 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 5 3 # 5 142 TRP A 70 TRP^? 14.31 O3 SO4 A 201 223 ASP A 52 ASP.? 10.10 O2 SO4 A 201 258 ALA A 103 ALA^? 18.27 O4 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 18.20 50.70 -6.77 15.49 53.36 -5.69 coo 127.91 41.73 23.55 129.18 40.35 24.44 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 141.00 37.49 25.74 139.80 37.53 24.78 20.86 53.82 -18.94 21.82 52.66 -18.69 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 6 3 # 6 142 TRP A 70 TRP^? 14.31 O3 SO4 A 201 223 ASP A 79 ASP^? 5.34 O4 SO4 A 201 258 ALA A 46 ALA~? 21.42 O2 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 18.20 50.70 -6.77 15.49 53.36 -5.69 coo 127.91 41.73 23.55 129.18 40.35 24.44 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 141.00 37.49 25.74 139.80 37.53 24.78 20.80 45.08 -18.57 19.53 45.83 -18.17 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 7 3 # 7 142 TRP A 70 TRP^? 14.31 O3 SO4 A 201 223 ASP A 79 ASP^? 5.34 O4 SO4 A 201 258 ALA A 51 ALA.? 16.68 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 18.20 50.70 -6.77 15.49 53.36 -5.69 coo 127.91 41.73 23.55 129.18 40.35 24.44 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 141.00 37.49 25.74 139.80 37.53 24.78 27.24 44.22 -13.46 28.03 42.99 -13.87 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 8 3 # 8 142 TRP A 70 TRP^? 14.31 O3 SO4 A 201 223 ASP A 79 ASP^? 5.34 O4 SO4 A 201 258 ALA A 95 ALA~? 18.86 O3 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 18.20 50.70 -6.77 15.49 53.36 -5.69 coo 127.91 41.73 23.55 129.18 40.35 24.44 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 141.00 37.49 25.74 139.80 37.53 24.78 15.32 59.53 -13.92 15.31 58.43 -14.94 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 9 3 # 9 142 TRP A 81 TRP^? 17.53 O3 SO4 A 201 223 ASP A 79 ASP^? 5.34 O4 SO4 A 201 258 ALA A 46 ALA~? 21.42 O2 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 16.50 54.91 -14.14 14.33 56.78 -11.43 coo 127.91 41.73 23.55 129.18 40.35 24.44 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 141.00 37.49 25.74 139.80 37.53 24.78 20.80 45.08 -18.57 19.53 45.83 -18.17 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 10 3 # 10 142 TRP A 81 TRP^? 17.53 O3 SO4 A 201 223 ASP A 79 ASP^? 5.34 O4 SO4 A 201 258 ALA A 51 ALA.? 16.68 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 16.50 54.91 -14.14 14.33 56.78 -11.43 coo 127.91 41.73 23.55 129.18 40.35 24.44 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 141.00 37.49 25.74 139.80 37.53 24.78 27.24 44.22 -13.46 28.03 42.99 -13.87 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 11 3 # 11 142 TRP A 81 TRP^? 17.53 O3 SO4 A 201 223 ASP A 79 ASP^? 5.34 O4 SO4 A 201 258 ALA A 127 ALA.? 19.09 O4 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 16.50 54.91 -14.14 14.33 56.78 -11.43 coo 127.91 41.73 23.55 129.18 40.35 24.44 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 141.00 37.49 25.74 139.80 37.53 24.78 23.77 65.15 -20.63 24.55 66.30 -20.02 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 12 3 # 12 142 TRP A 162 TRP^? 21.96 CL CL B 203 223 ASP A 16 ASP^? 19.84 O2 SO4 A 201 258 ALA B 15 ALA^? 9.07 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 127.91 41.73 23.55 129.18 40.35 24.44 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 141.00 37.49 25.74 139.80 37.53 24.78 33.44 29.49 -14.78 32.88 30.75 -15.46 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 13 3 # 13 142 TRP A 162 TRP^? 21.96 CL CL B 203 223 ASP A 16 ASP^? 19.84 O2 SO4 A 201 258 ALA B 154 ALA^? 14.54 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 127.91 41.73 23.55 129.18 40.35 24.44 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 141.00 37.49 25.74 139.80 37.53 24.78 38.72 30.85 -17.27 39.54 29.64 -16.86 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 14 3 # 14 142 TRP A 162 TRP^? 21.96 CL CL B 203 223 ASP A 18 ASP.? 23.99 O2 SO4 A 201 258 ALA A 51 ALA.? 16.68 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 127.91 41.73 23.55 129.18 40.35 24.44 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 141.00 37.49 25.74 139.80 37.53 24.78 27.24 44.22 -13.46 28.03 42.99 -13.87 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 15 3 # 15 142 TRP A 177 TRP^? 30.87 O4 SO4 A 201 223 ASP A 135 ASP~? 30.53 CL CL B 203 258 ALA A 111 ALA~? 36.44 O4 SO4 A 201 coo 128.40 33.01 26.67 128.12 36.28 28.81 19.75 53.60 -31.66 15.88 53.16 -31.11 coo 127.91 41.73 23.55 129.18 40.35 24.44 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 141.00 37.49 25.74 139.80 37.53 24.78 7.08 51.06 -31.33 6.61 50.50 -30.00 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 16 3 # 16 142 TRP B 70 TRP^? 14.54 O1 SO4 B 202 223 ASP B 52 ASP.? 10.23 O4 SO4 B 202 258 ALA B 100 ALA^? 9.34 O2 SO4 B 202 coo 128.40 33.01 26.67 128.12 36.28 28.81 47.70 15.42 -3.96 49.83 12.32 -2.76 coo 127.91 41.73 23.55 129.18 40.35 24.44 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 141.00 37.49 25.74 139.80 37.53 24.78 40.06 6.50 -8.88 38.93 7.23 -8.18 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 17 3 # 17 142 TRP B 70 TRP^? 14.54 O1 SO4 B 202 223 ASP B 52 ASP.? 10.23 O4 SO4 B 202 258 ALA B 103 ALA^? 18.39 O4 SO4 B 202 coo 128.40 33.01 26.67 128.12 36.28 28.81 47.70 15.42 -3.96 49.83 12.32 -2.76 coo 127.91 41.73 23.55 129.18 40.35 24.44 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 141.00 37.49 25.74 139.80 37.53 24.78 44.40 12.71 -15.97 43.67 13.98 -15.63 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 18 3 # 18 142 TRP B 70 TRP^? 14.54 O1 SO4 B 202 223 ASP B 79 ASP^? 5.64 O2 SO4 B 202 258 ALA B 46 ALA~? 21.10 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 47.70 15.42 -3.96 49.83 12.32 -2.76 coo 127.91 41.73 23.55 129.18 40.35 24.44 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 141.00 37.49 25.74 139.80 37.53 24.78 45.36 21.33 -15.79 46.42 20.27 -15.61 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 19 3 # 19 142 TRP B 70 TRP^? 14.54 O1 SO4 B 202 223 ASP B 79 ASP^? 5.64 O2 SO4 B 202 258 ALA B 51 ALA.? 11.87 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 47.70 15.42 -3.96 49.83 12.32 -2.76 coo 127.91 41.73 23.55 129.18 40.35 24.44 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 141.00 37.49 25.74 139.80 37.53 24.78 39.36 22.85 -10.60 38.84 24.20 -11.02 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 20 3 # 20 142 TRP B 70 TRP^? 14.54 O1 SO4 B 202 223 ASP B 79 ASP^? 5.64 O2 SO4 B 202 258 ALA B 95 ALA~? 18.89 O1 SO4 B 202 coo 128.40 33.01 26.67 128.12 36.28 28.81 47.70 15.42 -3.96 49.83 12.32 -2.76 coo 127.91 41.73 23.55 129.18 40.35 24.44 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 141.00 37.49 25.74 139.80 37.53 24.78 49.10 6.20 -11.06 49.30 7.28 -12.12 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 21 3 # 21 142 TRP B 81 TRP^? 17.38 O1 SO4 B 202 223 ASP B 79 ASP^? 5.64 O2 SO4 B 202 258 ALA B 46 ALA~? 21.10 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 48.58 10.75 -11.23 50.31 8.75 -8.31 coo 127.91 41.73 23.55 129.18 40.35 24.44 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 141.00 37.49 25.74 139.80 37.53 24.78 45.36 21.33 -15.79 46.42 20.27 -15.61 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 22 3 # 22 142 TRP B 81 TRP^? 17.38 O1 SO4 B 202 223 ASP B 79 ASP^? 5.64 O2 SO4 B 202 258 ALA B 51 ALA.? 11.87 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 48.58 10.75 -11.23 50.31 8.75 -8.31 coo 127.91 41.73 23.55 129.18 40.35 24.44 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 141.00 37.49 25.74 139.80 37.53 24.78 39.36 22.85 -10.60 38.84 24.20 -11.02 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 23 3 # 23 142 TRP B 81 TRP^? 17.38 O1 SO4 B 202 223 ASP B 79 ASP^? 5.64 O2 SO4 B 202 258 ALA B 127 ALA.? 19.46 O2 SO4 B 202 coo 128.40 33.01 26.67 128.12 36.28 28.81 48.58 10.75 -11.23 50.31 8.75 -8.31 coo 127.91 41.73 23.55 129.18 40.35 24.44 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 141.00 37.49 25.74 139.80 37.53 24.78 40.03 1.96 -17.76 39.06 0.86 -17.36 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 24 3 # 24 142 TRP B 162 TRP^? 19.28 CL CL B 203 223 ASP B 158 ASP.? 18.10 CL CL B 203 258 ALA B 15 ALA^? 9.07 CL CL B 203 coo 128.40 33.01 26.67 128.12 36.28 28.81 37.55 32.11 -25.58 34.94 29.29 -26.45 coo 127.91 41.73 23.55 129.18 40.35 24.44 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 141.00 37.49 25.74 139.80 37.53 24.78 33.44 29.49 -14.78 32.88 30.75 -15.46 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 25 3 # 25 142 TRP B 177 TRP^? 31.12 O2 SO4 B 202 223 ASP B 135 ASP~? 30.33 CL CL B 203 258 ALA B 111 ALA~? 36.75 O1 SO4 B 202 coo 128.40 33.01 26.67 128.12 36.28 28.81 45.60 12.61 -28.85 49.46 12.52 -28.08 coo 127.91 41.73 23.55 129.18 40.35 24.44 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 141.00 37.49 25.74 139.80 37.53 24.78 58.44 13.32 -28.53 59.07 13.74 -27.20 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 25 hits 2aat_c01 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP A 74 ASP.? -4.21 O2 SO4 A 201s 294 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 29.24 55.36 0.45 30.25 53.50 0.45 coo 33.16 106.80 7.72 33.34 104.87 6.92 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP A 135 ASP~? 30.53 CL CL B 203 294 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 33.16 106.80 7.72 33.34 104.87 6.92 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP A 147 ASP.? 14.36 CL CL B 203 294 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 33.16 106.80 7.72 33.34 104.87 6.92 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 # 4 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP A 166 ASP.? 11.63 CL CL B 203 294 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 33.16 106.80 7.72 33.34 104.87 6.92 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 5 3 # 5 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP A 166 ASP.? 11.63 CL CL B 203 294 ASP A 158 ASP.? 28.53 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 33.16 106.80 7.72 33.34 104.87 6.92 35.14 45.22 -28.92 37.28 45.17 -28.91 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 6 3 # 6 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP B 18 ASP.? 13.73 CL CL B 203 294 ASP A 158 ASP.? 28.53 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 33.16 106.80 7.72 33.34 104.87 6.92 35.14 45.22 -28.92 37.28 45.17 -28.91 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 7 3 # 7 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP B 18 ASP.? 13.73 CL CL B 203 294 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 33.16 106.80 7.72 33.34 104.87 6.92 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 8 3 # 8 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP B 147 ASP.? 29.53 CL CL B 203 294 ASP A 158 ASP.? 28.53 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 33.16 106.80 7.72 33.34 104.87 6.92 35.14 45.22 -28.92 37.28 45.17 -28.91 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 9 3 # 9 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP B 158 ASP.? 18.10 CL CL B 203 294 ASP A 158 ASP.? 28.53 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 33.16 106.80 7.72 33.34 104.87 6.92 35.14 45.22 -28.92 37.28 45.17 -28.91 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 10 3 # 10 193 ASP A 16 ASP^? 19.84 O2 SO4 A 201 231 ASP B 158 ASP.? 18.10 CL CL B 203 294 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 14.74 93.05 -1.00 14.30 94.22 0.73 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 33.16 106.80 7.72 33.34 104.87 6.92 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 11 3 # 11 193 ASP A 18 ASP.? 23.99 O2 SO4 A 201 231 ASP A 165 ASP.? 13.91 CL CL B 203 294 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 14.74 93.05 -1.00 14.30 94.22 0.73 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 33.16 106.80 7.72 33.34 104.87 6.92 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 12 3 # 12 193 ASP A 52 ASP.? 10.10 O2 SO4 A 201 231 ASP A 147 ASP.? 14.36 CL CL B 203 294 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 14.74 93.05 -1.00 14.30 94.22 0.73 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 13 3 # 13 193 ASP A 79 ASP^? 5.34 O4 SO4 A 201 231 ASP A 64 ASP.? 24.79 O3 SO4 A 201 294 ASP A 52 ASP.? 10.10 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 14.74 93.05 -1.00 14.30 94.22 0.73 5.36 51.73 -7.41 5.08 53.43 -6.17 coo 33.16 106.80 7.72 33.34 104.87 6.92 27.85 46.96 -9.87 29.03 47.89 -8.38 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 14 3 # 14 193 ASP A 79 ASP^? 5.34 O4 SO4 A 201 231 ASP A 64 ASP.? 24.79 O3 SO4 A 201 294 ASP A 74 ASP.? -4.21 O2 SO4 A 201s coo 27.89 102.52 14.98 29.35 101.92 13.57 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 14.74 93.05 -1.00 14.30 94.22 0.73 5.36 51.73 -7.41 5.08 53.43 -6.17 coo 33.16 106.80 7.72 33.34 104.87 6.92 29.24 55.36 0.45 30.25 53.50 0.45 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 15 3 # 15 193 ASP A 79 ASP^? 5.34 O4 SO4 A 201 231 ASP B 166 ASP.? 24.89 O2 SO4 A 201 294 ASP A 74 ASP.? -4.21 O2 SO4 A 201s coo 27.89 102.52 14.98 29.35 101.92 13.57 26.05 55.51 -8.88 27.40 56.46 -7.54 coo 14.74 93.05 -1.00 14.30 94.22 0.73 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 33.16 106.80 7.72 33.34 104.87 6.92 29.24 55.36 0.45 30.25 53.50 0.45 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 16 3 # 16 193 ASP A 147 ASP.? 14.36 CL CL B 203 231 ASP A 52 ASP.? 10.10 O2 SO4 A 201 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 14.74 93.05 -1.00 14.30 94.22 0.73 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 17 3 # 17 193 ASP A 147 ASP.? 14.36 CL CL B 203 231 ASP A 135 ASP~? 30.53 CL CL B 203 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 14.74 93.05 -1.00 14.30 94.22 0.73 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 18 3 # 18 193 ASP A 147 ASP.? 14.36 CL CL B 203 231 ASP A 136 ASP~? 33.35 CL CL B 203 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 14.74 93.05 -1.00 14.30 94.22 0.73 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 19 3 # 19 193 ASP A 158 ASP.? 28.53 CL CL B 203 231 ASP A 136 ASP~? 33.35 CL CL B 203 294 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 14.74 93.05 -1.00 14.30 94.22 0.73 12.11 41.85 -33.23 10.81 43.53 -32.98 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 20 3 # 20 193 ASP A 158 ASP.? 28.53 CL CL B 203 231 ASP B 158 ASP.? 18.10 CL CL B 203 294 ASP A 16 ASP^? 19.84 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 14.74 93.05 -1.00 14.30 94.22 0.73 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.21 43.75 -17.91 32.76 45.38 -19.21 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 21 3 # 21 193 ASP A 165 ASP.? 13.91 CL CL B 203 231 ASP A 18 ASP.? 23.99 O2 SO4 A 201 294 ASP B 18 ASP.? 13.73 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 33.16 106.80 7.72 33.34 104.87 6.92 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 22 3 # 22 193 ASP A 165 ASP.? 13.91 CL CL B 203 231 ASP A 18 ASP.? 23.99 O2 SO4 A 201 294 ASP B 158 ASP.? 18.10 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 23 3 # 23 193 ASP A 165 ASP.? 13.91 CL CL B 203 231 ASP A 52 ASP.? 10.10 O2 SO4 A 201 294 ASP A 147 ASP.? 14.36 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.74 93.05 -1.00 14.30 94.22 0.73 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 33.16 106.80 7.72 33.34 104.87 6.92 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 24 3 # 24 193 ASP A 165 ASP.? 13.91 CL CL B 203 231 ASP A 135 ASP~? 30.53 CL CL B 203 294 ASP A 147 ASP.? 14.36 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.74 93.05 -1.00 14.30 94.22 0.73 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 33.16 106.80 7.72 33.34 104.87 6.92 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 25 3 # 25 193 ASP A 165 ASP.? 13.91 CL CL B 203 231 ASP A 158 ASP.? 28.53 CL CL B 203 294 ASP B 18 ASP.? 13.73 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 33.16 106.80 7.72 33.34 104.87 6.92 31.68 21.14 -19.10 32.12 21.73 -21.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 26 3 # 26 193 ASP A 165 ASP.? 13.91 CL CL B 203 231 ASP A 158 ASP.? 28.53 CL CL B 203 294 ASP B 158 ASP.? 18.10 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 27 3 # 27 193 ASP A 165 ASP.? 13.91 CL CL B 203 231 ASP B 52 ASP.? 10.23 O4 SO4 B 202 294 ASP A 147 ASP.? 14.36 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 14.74 93.05 -1.00 14.30 94.22 0.73 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 33.16 106.80 7.72 33.34 104.87 6.92 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 28 3 # 28 193 ASP A 166 ASP.? 11.63 CL CL B 203 231 ASP A 16 ASP^? 19.84 O2 SO4 A 201 294 ASP A 147 ASP.? 14.36 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 33.16 106.80 7.72 33.34 104.87 6.92 16.08 28.22 -17.17 15.39 26.23 -17.08 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 29 3 # 29 193 ASP A 166 ASP.? 11.63 CL CL B 203 231 ASP A 16 ASP^? 19.84 O2 SO4 A 201 294 ASP B 158 ASP.? 18.10 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 30 3 # 30 193 ASP A 166 ASP.? 11.63 CL CL B 203 231 ASP B 79 ASP^? 5.64 O2 SO4 B 202 294 ASP B 158 ASP.? 18.10 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 25.28 23.82 -19.54 23.14 23.74 -19.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 31 3 # 31 193 ASP B 16 ASP^? 10.11 CL CL B 203 231 ASP A 18 ASP.? 23.99 O2 SO4 A 201 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 32 3 # 32 193 ASP B 16 ASP^? 10.11 CL CL B 203 231 ASP A 18 ASP.? 23.99 O2 SO4 A 201 294 ASP B 158 ASP.? 18.10 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 33 3 # 33 193 ASP B 16 ASP^? 10.11 CL CL B 203 231 ASP A 52 ASP.? 10.10 O2 SO4 A 201 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 14.74 93.05 -1.00 14.30 94.22 0.73 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 34 3 # 34 193 ASP B 16 ASP^? 10.11 CL CL B 203 231 ASP B 135 ASP~? 30.33 CL CL B 203 294 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 33.16 106.80 7.72 33.34 104.87 6.92 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 35 3 # 35 193 ASP B 16 ASP^? 10.11 CL CL B 203 231 ASP B 147 ASP.? 29.53 CL CL B 203 294 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 14.74 93.05 -1.00 14.30 94.22 0.73 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 33.16 106.80 7.72 33.34 104.87 6.92 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 36 3 # 36 193 ASP B 16 ASP^? 10.11 CL CL B 203 231 ASP B 166 ASP.? 24.89 O2 SO4 A 201 294 ASP B 52 ASP.? 10.23 O4 SO4 B 202 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 14.74 93.05 -1.00 14.30 94.22 0.73 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 33.16 106.80 7.72 33.34 104.87 6.92 38.35 20.38 -6.97 37.13 19.67 -5.41 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 37 3 # 37 193 ASP B 16 ASP^? 10.11 CL CL B 203 231 ASP B 166 ASP.? 24.89 O2 SO4 A 201 294 ASP B 158 ASP.? 18.10 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 14.74 93.05 -1.00 14.30 94.22 0.73 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.21 22.60 -26.09 30.17 22.42 -26.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 38 3 # 38 193 ASP B 18 ASP.? 13.73 CL CL B 203 231 ASP B 165 ASP.? 24.35 CL CL B 203 294 ASP A 165 ASP.? 13.91 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 31.68 21.14 -19.10 32.12 21.73 -21.09 coo 14.74 93.05 -1.00 14.30 94.22 0.73 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 33.16 106.80 7.72 33.34 104.87 6.92 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 39 3 # 39 193 ASP B 52 ASP.? 10.23 O4 SO4 B 202 231 ASP B 147 ASP.? 29.53 CL CL B 203 294 ASP B 16 ASP^? 10.11 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 14.74 93.05 -1.00 14.30 94.22 0.73 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 40 3 # 40 193 ASP B 147 ASP.? 29.53 CL CL B 203 231 ASP B 52 ASP.? 10.23 O4 SO4 B 202 294 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 14.74 93.05 -1.00 14.30 94.22 0.73 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 33.16 106.80 7.72 33.34 104.87 6.92 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 41 3 # 41 193 ASP B 147 ASP.? 29.53 CL CL B 203 231 ASP B 135 ASP~? 30.33 CL CL B 203 294 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 33.16 106.80 7.72 33.34 104.87 6.92 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 42 3 # 42 193 ASP B 147 ASP.? 29.53 CL CL B 203 231 ASP B 136 ASP~? 35.38 CL CL B 203 294 ASP B 166 ASP.? 24.89 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 14.74 93.05 -1.00 14.30 94.22 0.73 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 33.16 106.80 7.72 33.34 104.87 6.92 44.37 42.96 -16.74 46.40 42.79 -16.09 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 43 3 # 43 193 ASP B 158 ASP.? 18.10 CL CL B 203 231 ASP A 158 ASP.? 28.53 CL CL B 203 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 44 3 # 44 193 ASP B 158 ASP.? 18.10 CL CL B 203 231 ASP A 158 ASP.? 28.53 CL CL B 203 294 ASP B 16 ASP^? 10.11 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 45 3 # 45 193 ASP B 158 ASP.? 18.10 CL CL B 203 231 ASP B 79 ASP^? 5.64 O2 SO4 B 202 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 46 3 # 46 193 ASP B 158 ASP.? 18.10 CL CL B 203 231 ASP B 136 ASP~? 35.38 CL CL B 203 294 ASP B 16 ASP^? 10.11 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.53 24.74 -14.92 33.82 22.97 -16.03 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 47 3 # 47 193 ASP B 158 ASP.? 18.10 CL CL B 203 231 ASP B 165 ASP.? 24.35 CL CL B 203 294 ASP A 165 ASP.? 13.91 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 33.16 106.80 7.72 33.34 104.87 6.92 23.54 28.49 -20.46 22.55 27.96 -22.28 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 48 3 # 48 193 ASP B 158 ASP.? 18.10 CL CL B 203 231 ASP B 165 ASP.? 24.35 CL CL B 203 294 ASP A 166 ASP.? 11.63 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 32.21 22.60 -26.09 30.17 22.42 -26.60 coo 14.74 93.05 -1.00 14.30 94.22 0.73 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 33.16 106.80 7.72 33.34 104.87 6.92 25.28 23.82 -19.54 23.14 23.74 -19.60 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 49 3 # 49 193 ASP B 165 ASP.? 24.35 CL CL B 203 231 ASP B 52 ASP.? 10.23 O4 SO4 B 202 294 ASP B 147 ASP.? 29.53 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 14.74 93.05 -1.00 14.30 94.22 0.73 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 33.16 106.80 7.72 33.34 104.87 6.92 52.99 37.46 -14.27 53.96 39.20 -13.53 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 50 3 # 50 193 ASP B 165 ASP.? 24.35 CL CL B 203 231 ASP B 135 ASP~? 30.33 CL CL B 203 294 ASP B 147 ASP.? 29.53 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 33.16 106.80 7.72 33.34 104.87 6.92 52.99 37.46 -14.27 53.96 39.20 -13.53 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 51 3 # 51 193 ASP B 166 ASP.? 24.89 O2 SO4 A 201 231 ASP B 16 ASP^? 10.11 CL CL B 203 294 ASP A 18 ASP.? 23.99 O2 SO4 A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 33.16 106.80 7.72 33.34 104.87 6.92 35.31 47.04 -22.18 34.84 45.98 -23.97 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 52 3 # 52 193 ASP B 166 ASP.? 24.89 O2 SO4 A 201 231 ASP B 16 ASP^? 10.11 CL CL B 203 294 ASP B 147 ASP.? 29.53 CL CL B 203 coo 27.89 102.52 14.98 29.35 101.92 13.57 44.37 42.96 -16.74 46.40 42.79 -16.09 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 33.16 106.80 7.72 33.34 104.87 6.92 52.99 37.46 -14.27 53.96 39.20 -13.53 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 52 hits 2amg_c06 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG A 39 ARG~? 27.60 O2 SO4 A 201 A 161 ASP A 135 ASP~? 30.53 CL CL B 203 A 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG A 43 ARG~? 21.16 CL CL B 203 A 161 ASP A 52 ASP.? 10.10 O2 SO4 A 201 A 174 TYR A 50 TYR~? 16.99 O2 SO4 A 201 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 13.83 43.55 -14.62 12.48 41.53 -12.77 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 27.85 46.96 -9.87 29.03 47.89 -8.38 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 25.15 49.16 -16.65 24.90 50.91 -18.81 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 3 3 # 3 A 14 ARG A 110 ARG~? 42.02 CL CL B 203 A 161 ASP A 135 ASP~? 30.53 CL CL B 203 A 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 3.93 48.32 -34.88 2.67 46.51 -37.04 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 4 3 # 4 A 14 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 161 ASP B 135 ASP~? 30.33 CL CL B 203 A 174 TYR B 133 TYR^? 31.17 CL CL B 203 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 48.83 16.45 -27.74 50.79 17.58 -29.40 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 5 3 # 5 A 14 ARG B 39 ARG~? 27.56 O4 SO4 B 202 A 161 ASP B 136 ASP~? 35.38 CL CL B 203 A 174 TYR B 133 TYR^? 31.17 CL CL B 203 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 54.69 22.94 -30.23 55.58 21.02 -29.87 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 48.83 16.45 -27.74 50.79 17.58 -29.40 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 6 3 # 6 A 14 ARG B 43 ARG~? 25.25 O4 SO4 B 202 A 161 ASP B 52 ASP.? 10.23 O4 SO4 B 202 A 174 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 52.54 21.81 -11.81 54.35 23.52 -10.03 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 38.35 20.38 -6.97 37.13 19.67 -5.41 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 40.69 17.69 -13.90 40.63 15.92 -16.06 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 6 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 39 ARG~? 27.60 O2 SO4 A 201 B 161 ASP A 135 ASP~? 30.53 CL CL B 203 B 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -14.86 10.19 8.14 -14.82 12.31 8.42 16.71 44.39 -33.44 18.14 42.86 -33.63 coo -21.46 12.70 8.53 -19.04 12.30 7.24 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG A 43 ARG~? 21.16 CL CL B 203 B 161 ASP A 52 ASP.? 10.10 O2 SO4 A 201 B 174 TYR A 50 TYR~? 16.99 O2 SO4 A 201 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -14.86 10.19 8.14 -14.82 12.31 8.42 27.85 46.96 -9.87 29.03 47.89 -8.38 coo -21.46 12.70 8.53 -19.04 12.30 7.24 25.15 49.16 -16.65 24.90 50.91 -18.81 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 3 3 # 3 B 14 ARG A 110 ARG~? 42.02 CL CL B 203 B 161 ASP A 135 ASP~? 30.53 CL CL B 203 B 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 3.93 48.32 -34.88 2.67 46.51 -37.04 coo -14.86 10.19 8.14 -14.82 12.31 8.42 16.71 44.39 -33.44 18.14 42.86 -33.63 coo -21.46 12.70 8.53 -19.04 12.30 7.24 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 4 3 # 4 B 14 ARG B 39 ARG~? 27.56 O4 SO4 B 202 B 161 ASP B 135 ASP~? 30.33 CL CL B 203 B 174 TYR B 133 TYR^? 31.17 CL CL B 203 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -14.86 10.19 8.14 -14.82 12.31 8.42 49.61 21.30 -30.64 48.45 23.04 -30.81 coo -21.46 12.70 8.53 -19.04 12.30 7.24 48.83 16.45 -27.74 50.79 17.58 -29.40 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 5 3 # 5 B 14 ARG B 39 ARG~? 27.56 O4 SO4 B 202 B 161 ASP B 136 ASP~? 35.38 CL CL B 203 B 174 TYR B 133 TYR^? 31.17 CL CL B 203 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -14.86 10.19 8.14 -14.82 12.31 8.42 54.69 22.94 -30.23 55.58 21.02 -29.87 coo -21.46 12.70 8.53 -19.04 12.30 7.24 48.83 16.45 -27.74 50.79 17.58 -29.40 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 6 3 # 6 B 14 ARG B 43 ARG~? 25.25 O4 SO4 B 202 B 161 ASP B 52 ASP.? 10.23 O4 SO4 B 202 B 174 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -14.86 10.19 8.14 -14.82 12.31 8.42 38.35 20.38 -6.97 37.13 19.67 -5.41 coo -21.46 12.70 8.53 -19.04 12.30 7.24 40.69 17.69 -13.90 40.63 15.92 -16.06 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 6 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 39 ARG~? 27.60 O2 SO4 A 201 C 161 ASP A 135 ASP~? 30.53 CL CL B 203 C 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo 2.84 19.43 40.34 1.59 20.35 37.65 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -0.62 11.10 28.05 -0.65 13.15 27.46 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 5.94 13.28 27.17 3.53 13.05 28.58 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG A 110 ARG~? 42.02 CL CL B 203 C 161 ASP A 135 ASP~? 30.53 CL CL B 203 C 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo 2.84 19.43 40.34 1.59 20.35 37.65 3.93 48.32 -34.88 2.67 46.51 -37.04 coo -0.62 11.10 28.05 -0.65 13.15 27.46 16.71 44.39 -33.44 18.14 42.86 -33.63 coo 5.94 13.28 27.17 3.53 13.05 28.58 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 3 3 # 3 C 14 ARG B 39 ARG~? 27.56 O4 SO4 B 202 C 161 ASP B 135 ASP~? 30.33 CL CL B 203 C 174 TYR B 133 TYR^? 31.17 CL CL B 203 coo 2.84 19.43 40.34 1.59 20.35 37.65 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -0.62 11.10 28.05 -0.65 13.15 27.46 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 5.94 13.28 27.17 3.53 13.05 28.58 48.83 16.45 -27.74 50.79 17.58 -29.40 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG A 39 ARG~? 27.60 O2 SO4 A 201 D 161 ASP A 135 ASP~? 30.53 CL CL B 203 D 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 16.71 44.39 -33.44 18.14 42.86 -33.63 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG A 43 ARG~? 21.16 CL CL B 203 D 161 ASP A 52 ASP.? 10.10 O2 SO4 A 201 D 174 TYR A 50 TYR~? 16.99 O2 SO4 A 201 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 27.85 46.96 -9.87 29.03 47.89 -8.38 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 25.15 49.16 -16.65 24.90 50.91 -18.81 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 3 3 # 3 D 14 ARG A 110 ARG~? 42.02 CL CL B 203 D 161 ASP A 135 ASP~? 30.53 CL CL B 203 D 174 TYR A 133 TYR^? 32.81 O4 SO4 A 201 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 3.93 48.32 -34.88 2.67 46.51 -37.04 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 16.71 44.39 -33.44 18.14 42.86 -33.63 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 17.01 49.27 -30.66 15.25 47.83 -32.31 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 4 3 # 4 D 14 ARG B 39 ARG~? 27.56 O4 SO4 B 202 D 161 ASP B 135 ASP~? 30.33 CL CL B 203 D 174 TYR B 133 TYR^? 31.17 CL CL B 203 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 49.61 21.30 -30.64 48.45 23.04 -30.81 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 48.83 16.45 -27.74 50.79 17.58 -29.40 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 5 3 # 5 D 14 ARG B 39 ARG~? 27.56 O4 SO4 B 202 D 161 ASP B 136 ASP~? 35.38 CL CL B 203 D 174 TYR B 133 TYR^? 31.17 CL CL B 203 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 57.17 19.82 -16.25 56.33 16.88 -15.94 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 54.69 22.94 -30.23 55.58 21.02 -29.87 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 48.83 16.45 -27.74 50.79 17.58 -29.40 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 6 3 # 6 D 14 ARG B 43 ARG~? 25.25 O4 SO4 B 202 D 161 ASP B 52 ASP.? 10.23 O4 SO4 B 202 D 174 TYR B 50 TYR~? 17.17 O4 SO4 B 202 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 52.54 21.81 -11.81 54.35 23.52 -10.03 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 38.35 20.38 -6.97 37.13 19.67 -5.41 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 40.69 17.69 -13.90 40.63 15.92 -16.06 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 6 hits 2c7v_c11 naa= 3 ULMN 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 1 3 # 1 65 THR A 97 THR~? 18.68 O3 SO4 A 201 242 CYH A 123 CYH~? 26.41 O4 SO4 A 201 270 PHE A 126 PHE.? 22.45 O4 SO4 A 201 coo 12.97 28.35 3.84 11.81 28.07 2.09 17.70 64.53 -12.58 15.92 65.64 -13.03 coo 8.65 19.49 -2.27 10.50 20.91 -0.59 16.65 63.11 -25.17 15.14 60.77 -25.01 coo 9.41 24.60 -3.66 7.52 26.57 -4.16 17.68 64.47 -20.11 15.06 65.33 -19.53 ULMN 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 2 3 # 2 65 THR B 97 THR~? 18.65 O1 SO4 B 202 242 CYH B 123 CYH~? 26.91 O2 SO4 B 202 270 PHE B 126 PHE.? 22.81 O1 SO4 B 202 coo 12.97 28.35 3.84 11.81 28.07 2.09 46.19 1.62 -9.66 47.84 0.24 -10.02 coo 8.65 19.49 -2.27 10.50 20.91 -0.59 47.23 3.07 -22.15 49.04 5.20 -22.47 coo 9.41 24.60 -3.66 7.52 26.57 -4.16 46.15 1.60 -17.22 48.54 0.22 -16.67 2cnd_c01 source 2cnd NADH-DEPENDENT NITRATE REDUCTASE (CYTOCHROME B: 2 hits 2cnd_c01 naa= 3 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 1 3 # 1 A 197 ASP A 88 ASP~? 29.34 O3 SO4 A 201 A 233 GLU A 89 GLU~? 32.07 O4 SO4 A 201 A 300 ASN A 119 ASN~? 31.45 O4 SO4 A 201 coo 12.51 17.07 49.46 12.44 16.89 47.35 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 6.52 19.14 48.16 7.77 18.42 46.61 7.10 64.61 -22.00 6.35 64.00 -23.92 coo 9.30 22.40 41.76 10.10 20.96 40.36 11.73 60.90 -27.86 9.72 60.89 -27.11 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 2 3 # 2 A 197 ASP B 79 ASP^? 5.64 O2 SO4 B 202 A 233 GLU B 101 GLU^? 13.49 O2 SO4 B 202 A 300 ASN B 128 ASN.? 16.24 O2 SO4 B 202 coo 12.51 17.07 49.46 12.44 16.89 47.35 39.00 11.56 -6.02 37.46 10.80 -4.75 coo 6.52 19.14 48.16 7.77 18.42 46.61 39.44 10.40 -13.31 37.47 11.26 -13.58 coo 9.30 22.40 41.76 10.10 20.96 40.36 40.54 4.79 -14.04 42.49 4.20 -13.37 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 3 3 # 3 A 197 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 233 GLU B 89 GLU~? 31.72 O1 SO4 B 202 A 300 ASN B 119 ASN~? 31.61 O1 SO4 B 202 coo 12.51 17.07 49.46 12.44 16.89 47.35 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 6.52 19.14 48.16 7.77 18.42 46.61 54.09 -0.06 -20.39 55.59 -1.00 -21.64 coo 9.30 22.40 41.76 10.10 20.96 40.36 52.38 4.31 -25.10 54.19 3.61 -24.21 2cpu_c01 source 2cpu ALPHA-AMYLASE : 3 hits 2cpu_c01 naa= 3 ULMN 3 2dbt_c00 CHITINASE C user 1 3 # 1 A 147 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 156 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 194 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 74.14 15.91 8.55 72.08 15.36 8.63 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 67.47 20.07 1.34 65.99 20.06 2.88 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 67.44 25.26 13.91 67.54 23.65 15.28 57.24 17.95 -26.18 59.03 17.74 -27.34 ULMN 3 2dbt_c00 CHITINASE C user 2 3 # 2 A 147 GLU B 68 GLU.? 23.74 O4 SO4 B 202 A 156 GLU B 35 GLU.? 28.14 O4 SO4 B 202 A 194 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 74.14 15.91 8.55 72.08 15.36 8.63 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 67.47 20.07 1.34 65.99 20.06 2.88 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 67.44 25.26 13.91 67.54 23.65 15.28 57.24 17.95 -26.18 59.03 17.74 -27.34 2dbt_c00 source 2dbt CHITINASE C : 2 hits 2dbt_c00 naa= 3 ULMN 3 2dbt_c01 CHITINASE C user 1 3 # 1 B 147 GLU B 35 GLU.? 28.14 O4 SO4 B 202 B 156 GLU B 68 GLU.? 23.74 O4 SO4 B 202 B 194 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 45.64 63.11 17.20 47.48 62.43 16.45 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 54.43 67.89 19.82 55.62 67.90 18.07 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 49.79 70.75 7.78 50.10 68.90 6.86 57.24 17.95 -26.18 59.03 17.74 -27.34 ULMN 3 2dbt_c01 CHITINASE C user 2 3 # 2 B 147 GLU B 68 GLU.? 23.74 O4 SO4 B 202 B 156 GLU B 35 GLU.? 28.14 O4 SO4 B 202 B 194 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 45.64 63.11 17.20 47.48 62.43 16.45 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 54.43 67.89 19.82 55.62 67.90 18.07 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 49.79 70.75 7.78 50.10 68.90 6.86 57.24 17.95 -26.18 59.03 17.74 -27.34 2dbt_c01 source 2dbt CHITINASE C : 2 hits 2dbt_c01 naa= 3 ULMN 3 2dbt_c02 CHITINASE C user 1 3 # 1 C 147 GLU B 35 GLU.? 28.14 O4 SO4 B 202 C 156 GLU B 68 GLU.? 23.74 O4 SO4 B 202 C 194 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 41.23 29.31 13.28 43.03 29.85 12.29 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 44.75 23.09 5.51 46.77 22.91 6.12 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 49.75 21.00 18.12 50.45 23.02 18.26 57.24 17.95 -26.18 59.03 17.74 -27.34 ULMN 3 2dbt_c02 CHITINASE C user 2 3 # 2 C 147 GLU B 68 GLU.? 23.74 O4 SO4 B 202 C 156 GLU B 35 GLU.? 28.14 O4 SO4 B 202 C 194 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 41.23 29.31 13.28 43.03 29.85 12.29 52.13 16.66 -12.75 54.11 15.89 -12.66 coo 44.75 23.09 5.51 46.77 22.91 6.12 58.35 23.06 -14.04 56.92 23.13 -12.46 coo 49.75 21.00 18.12 50.45 23.02 18.26 57.24 17.95 -26.18 59.03 17.74 -27.34 2dbt_c02 source 2dbt CHITINASE C : 2 hits 2dbt_c02 naa= 3 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 150 TYR A 107 TYR.? 29.41 CL CL B 203 A 245 ASP A 135 ASP~? 30.53 CL CL B 203 A 273 LYS A 141 LYS~? 27.34 CL CL B 203 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 16.71 44.39 -33.44 18.14 42.86 -33.63 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 17.29 34.80 -28.79 19.89 34.33 -34.52 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 150 TYR B 107 TYR.? 30.85 O4 SO4 B 202 A 245 ASP B 135 ASP~? 30.33 CL CL B 203 A 273 LYS B 141 LYS~? 32.09 CL CL B 203 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 49.61 21.30 -30.64 48.45 23.04 -30.81 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 50.65 30.91 -26.07 50.03 31.36 -31.64 2gsa_c02 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 2 hits 2gsa_c02 naa= 3 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 157 PHE A 22 PHE^? 18.06 CL CL B 203 A 245 ASP B 165 ASP.? 24.35 CL CL B 203 A 273 LYS B 9 LYS^? 26.01 CL CL B 203 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 45.25 37.97 -17.38 46.58 38.45 -18.99 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 50.82 33.22 -7.07 51.79 32.01 -1.71 2gsa_c04 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 1 hits 2gsa_c04 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 22 PHE^? 18.06 CL CL B 203 A 263 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 292 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 51.51 50.32 16.39 52.13 49.68 13.75 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 54.43 44.82 23.74 55.21 45.06 21.80 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 63.95 45.30 16.71 59.11 49.15 16.05 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 177 PHE A 22 PHE^? 18.06 CL CL B 203 A 263 ASP A 18 ASP.? 23.99 O2 SO4 A 201 A 292 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 51.51 50.32 16.39 52.13 49.68 13.75 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 54.43 44.82 23.74 55.21 45.06 21.80 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 63.95 45.30 16.71 59.11 49.15 16.05 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 A 177 PHE B 22 PHE^? 5.22 CL CL B 203 A 263 ASP A 165 ASP.? 13.91 CL CL B 203 A 292 LYS A 9 LYS^? 13.80 CL CL B 203 coo 51.51 50.32 16.39 52.13 49.68 13.75 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 54.43 44.82 23.74 55.21 45.06 21.80 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 63.95 45.30 16.71 59.11 49.15 16.05 17.34 32.48 -9.89 16.06 33.15 -4.52 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 3 hits 2oat_c03 naa= 3 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 177 PHE A 22 PHE^? 18.06 CL CL B 203 B 263 ASP A 18 ASP.? 23.99 O2 SO4 A 201 B 292 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 49.99 26.05 6.28 51.46 26.87 8.49 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 60.53 31.67 0.97 57.79 27.51 3.63 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 177 PHE A 22 PHE^? 18.06 CL CL B 203 B 263 ASP A 18 ASP.? 23.99 O2 SO4 A 201 B 292 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 49.99 26.05 6.28 51.46 26.87 8.49 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 60.53 31.67 0.97 57.79 27.51 3.63 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 B 177 PHE B 22 PHE^? 5.22 CL CL B 203 B 263 ASP A 165 ASP.? 13.91 CL CL B 203 B 292 LYS A 9 LYS^? 13.80 CL CL B 203 coo 49.99 26.05 6.28 51.46 26.87 8.49 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 60.53 31.67 0.97 57.79 27.51 3.63 17.34 32.48 -9.89 16.06 33.15 -4.52 2oat_c04 source 2oat ORNITHINE AMINOTRANSFERASE : 3 hits 2oat_c04 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 22 PHE^? 18.06 CL CL B 203 C 263 ASP A 18 ASP.? 23.99 O2 SO4 A 201 C 292 LYS A 49 LYS~? 21.61 O2 SO4 A 201 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 19.84 12.02 9.33 18.68 11.23 7.75 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 12.82 3.49 4.98 17.80 5.59 1.90 26.03 45.00 -18.94 27.16 48.58 -22.77 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 177 PHE A 22 PHE^? 18.06 CL CL B 203 C 263 ASP A 18 ASP.? 23.99 O2 SO4 A 201 C 292 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 37.35 40.04 -13.97 38.92 40.57 -16.22 coo 19.84 12.02 9.33 18.68 11.23 7.75 35.31 47.04 -22.18 34.84 45.98 -23.97 coo 12.82 3.49 4.98 17.80 5.59 1.90 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 C 177 PHE B 22 PHE^? 5.22 CL CL B 203 C 263 ASP A 165 ASP.? 13.91 CL CL B 203 C 292 LYS A 9 LYS^? 13.80 CL CL B 203 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 30.20 29.70 -11.84 28.90 29.99 -14.32 coo 19.84 12.02 9.33 18.68 11.23 7.75 23.54 28.49 -20.46 22.55 27.96 -22.28 coo 12.82 3.49 4.98 17.80 5.59 1.90 17.34 32.48 -9.89 16.06 33.15 -4.52 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 3 hits 2oat_c05 naa= 3 ULMN 3 2oat_c06 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 178 TRP A 115 TRP~? 30.09 O4 SO4 A 201 A 263 ASP A 88 ASP~? 29.34 O3 SO4 A 201 A 292 LYS A 94 LYS~? 22.47 O3 SO4 A 201 coo 48.96 45.07 19.49 48.62 41.39 18.16 9.03 56.91 -26.77 12.93 56.71 -26.19 coo 54.43 44.82 23.74 55.21 45.06 21.80 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 63.95 45.30 16.71 59.11 49.15 16.05 12.51 62.07 -13.42 8.27 61.24 -10.02 ULMN 3 2oat_c06 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 178 TRP A 162 TRP^? 21.96 CL CL B 203 A 263 ASP A 158 ASP.? 28.53 CL CL B 203 A 292 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 48.96 45.07 19.49 48.62 41.39 18.16 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 54.43 44.82 23.74 55.21 45.06 21.80 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 63.95 45.30 16.71 59.11 49.15 16.05 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 2oat_c06 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 A 178 TRP B 115 TRP~? 30.44 O1 SO4 B 202 A 263 ASP B 88 ASP~? 29.32 O1 SO4 B 202 A 292 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo 48.96 45.07 19.49 48.62 41.39 18.16 55.54 8.04 -24.08 51.69 8.57 -23.51 coo 54.43 44.82 23.74 55.21 45.06 21.80 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 63.95 45.30 16.71 59.11 49.15 16.05 51.38 3.18 -10.50 55.68 5.47 -6.55 2oat_c06 source 2oat ORNITHINE AMINOTRANSFERASE : 3 hits 2oat_c06 naa= 3 ULMN 3 2oat_c07 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 178 TRP A 115 TRP~? 30.09 O4 SO4 A 201 B 263 ASP A 88 ASP~? 29.34 O3 SO4 A 201 B 292 LYS A 94 LYS~? 22.47 O3 SO4 A 201 coo 45.83 31.15 4.65 45.88 34.74 6.24 9.03 56.91 -26.77 12.93 56.71 -26.19 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 60.53 31.67 0.97 57.79 27.51 3.63 12.51 62.07 -13.42 8.27 61.24 -10.02 ULMN 3 2oat_c07 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 178 TRP B 115 TRP~? 30.44 O1 SO4 B 202 B 263 ASP B 88 ASP~? 29.32 O1 SO4 B 202 B 292 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo 45.83 31.15 4.65 45.88 34.74 6.24 55.54 8.04 -24.08 51.69 8.57 -23.51 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 60.53 31.67 0.97 57.79 27.51 3.63 51.38 3.18 -10.50 55.68 5.47 -6.55 2oat_c07 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c07 naa= 3 ULMN 3 2oat_c08 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 178 TRP A 115 TRP~? 30.09 O4 SO4 A 201 C 263 ASP A 88 ASP~? 29.34 O3 SO4 A 201 C 292 LYS A 94 LYS~? 22.47 O3 SO4 A 201 coo 20.52 16.65 4.15 17.32 18.91 4.39 9.03 56.91 -26.77 12.93 56.71 -26.19 coo 19.84 12.02 9.33 18.68 11.23 7.75 6.40 60.12 -21.74 5.76 60.37 -19.72 coo 12.82 3.49 4.98 17.80 5.59 1.90 12.51 62.07 -13.42 8.27 61.24 -10.02 ULMN 3 2oat_c08 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 178 TRP A 162 TRP^? 21.96 CL CL B 203 C 263 ASP A 158 ASP.? 28.53 CL CL B 203 C 292 LYS B 167 LYS.? 28.27 O2 SO4 A 201 coo 20.52 16.65 4.15 17.32 18.91 4.39 31.84 38.06 -26.77 31.10 35.95 -30.01 coo 19.84 12.02 9.33 18.68 11.23 7.75 35.14 45.22 -28.92 37.28 45.17 -28.91 coo 12.82 3.49 4.98 17.80 5.59 1.90 46.06 42.14 -21.13 50.44 45.35 -19.26 ULMN 3 2oat_c08 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 C 178 TRP B 115 TRP~? 30.44 O1 SO4 B 202 C 263 ASP B 88 ASP~? 29.32 O1 SO4 B 202 C 292 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo 20.52 16.65 4.15 17.32 18.91 4.39 55.54 8.04 -24.08 51.69 8.57 -23.51 coo 19.84 12.02 9.33 18.68 11.23 7.75 57.84 4.08 -18.92 58.47 4.21 -16.88 coo 12.82 3.49 4.98 17.80 5.59 1.90 51.38 3.18 -10.50 55.68 5.47 -6.55 2oat_c08 source 2oat ORNITHINE AMINOTRANSFERASE : 3 hits 2oat_c08 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 16 ASP^? 19.84 O2 SO4 A 201 A 151 LYS A 49 LYS~? 21.61 O2 SO4 A 201 A 186 THR A 155 THR^? 16.70 CL CL B 203 coo 41.42 17.90 44.98 43.39 18.36 45.61 33.21 43.75 -17.91 32.76 45.38 -19.21 coo 45.75 16.58 39.61 47.43 18.26 45.54 26.03 45.00 -18.94 27.16 48.58 -22.77 coo 45.88 23.02 44.72 46.99 21.16 44.68 32.10 37.97 -21.41 33.49 36.33 -21.72 ULMN 3 2phk_c02 MC-PEPTIDE user 2 3 # 2 A 149 ASP A 147 ASP.? 14.36 CL CL B 203 A 151 LYS A 9 LYS^? 13.80 CL CL B 203 A 186 THR A 151 THR^? 5.27 CL CL B 203 coo 41.42 17.90 44.98 43.39 18.36 45.61 16.08 28.22 -17.17 15.39 26.23 -17.08 coo 45.75 16.58 39.61 47.43 18.26 45.54 17.34 32.48 -9.89 16.06 33.15 -4.52 coo 45.88 23.02 44.72 46.99 21.16 44.68 23.61 29.36 -14.77 24.70 27.83 -13.70 ULMN 3 2phk_c02 MC-PEPTIDE user 3 3 # 3 A 149 ASP B 16 ASP^? 10.11 CL CL B 203 A 151 LYS B 49 LYS~? 17.28 CL CL B 203 A 186 THR B 155 THR^? 12.79 CL CL B 203 coo 41.42 17.90 44.98 43.39 18.36 45.61 33.53 24.74 -14.92 33.82 22.97 -16.03 coo 45.75 16.58 39.61 47.43 18.26 45.54 40.33 21.93 -16.14 38.56 18.89 -19.75 coo 45.88 23.02 44.72 46.99 21.16 44.68 35.45 29.84 -18.92 33.82 31.13 -19.55 ULMN 3 2phk_c02 MC-PEPTIDE user 4 3 # 4 A 149 ASP B 147 ASP.? 29.53 CL CL B 203 A 151 LYS B 9 LYS^? 26.01 CL CL B 203 A 186 THR B 151 THR^? 20.59 CL CL B 203 coo 41.42 17.90 44.98 43.39 18.36 45.61 52.99 37.46 -14.27 53.96 39.20 -13.53 coo 45.75 16.58 39.61 47.43 18.26 45.54 50.82 33.22 -7.07 51.79 32.01 -1.71 coo 45.88 23.02 44.72 46.99 21.16 44.68 45.05 37.16 -12.09 44.11 38.87 -11.18 2phk_c02 source 2phk MC-PEPTIDE : 4 hits 2phk_c02 naa= 3 ULMN 3 2phk_c03 MC-PEPTIDE user 1 3 # 1 A 149 ASP B 165 ASP.? 24.35 CL CL B 203 A 151 LYS B 167 LYS.? 28.27 O2 SO4 A 201 A 154 ASN B 168 ASN.? 28.30 CL CL B 203 coo 41.42 17.90 44.98 43.39 18.36 45.61 45.25 37.97 -17.38 46.58 38.45 -18.99 coo 45.75 16.58 39.61 47.43 18.26 45.54 46.06 42.14 -21.13 50.44 45.35 -19.26 coo 44.77 13.10 43.25 45.01 14.21 45.03 46.24 38.33 -23.56 47.43 39.28 -25.06 2phk_c03 source 2phk MC-PEPTIDE : 1 hits 2phk_c03 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 13 ASN^? 10.47 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 30.72 33.91 -14.09 32.77 34.57 -14.11 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 20 ASN.? 21.46 O2 SO4 A 201 coo 5.80 63.03 55.85 5.52 65.03 56.45 39.64 45.42 -15.90 41.15 44.67 -17.18 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 73 ASN.? -3.54 O3 SO4 A 201s coo 5.80 63.03 55.85 5.52 65.03 56.45 27.08 56.20 -4.04 25.99 58.02 -3.77 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 108 ASN~? 34.79 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 8.53 47.32 -28.63 6.99 46.32 -29.72 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 5 1 # 5 A 461 ASN A 119 ASN~? 31.45 O4 SO4 A 201 coo 5.80 63.03 55.85 5.52 65.03 56.45 11.73 60.90 -27.86 9.72 60.89 -27.11 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 6 1 # 6 A 461 ASN A 128 ASN.? 15.88 O4 SO4 A 201 coo 5.80 63.03 55.85 5.52 65.03 56.45 23.73 62.15 -16.98 21.71 62.36 -16.27 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 7 1 # 7 A 461 ASN A 168 ASN.? 18.60 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 22.93 27.85 -26.42 21.77 26.15 -26.99 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 8 1 # 8 A 461 ASN A 169 ASN^? 18.01 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 27.78 29.97 -27.47 29.46 31.04 -26.71 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 9 1 # 9 A 461 ASN A 173 ASN.? 27.41 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 25.34 43.35 -31.46 27.19 42.45 -31.89 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 10 1 # 10 A 461 ASN B 13 ASN^? 10.38 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 37.49 33.73 -11.31 35.37 33.37 -11.20 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 11 1 # 11 A 461 ASN B 20 ASN.? 4.66 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 26.68 23.02 -13.35 25.29 24.43 -12.57 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 12 1 # 12 A 461 ASN B 73 ASN.? -3.57 O1 SO4 B 202s coo 5.80 63.03 55.85 5.52 65.03 56.45 37.83 10.96 -1.17 38.79 9.10 -0.83 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 13 1 # 13 A 461 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 5.80 63.03 55.85 5.52 65.03 56.45 57.24 17.95 -26.18 59.03 17.74 -27.34 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 14 1 # 14 A 461 ASN B 119 ASN~? 31.61 O1 SO4 B 202 coo 5.80 63.03 55.85 5.52 65.03 56.45 52.38 4.31 -25.10 54.19 3.61 -24.21 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 15 1 # 15 A 461 ASN B 128 ASN.? 16.24 O2 SO4 B 202 coo 5.80 63.03 55.85 5.52 65.03 56.45 40.54 4.79 -14.04 42.49 4.20 -13.37 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 16 1 # 16 A 461 ASN B 168 ASN.? 28.30 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 46.24 38.33 -23.56 47.43 39.28 -25.06 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 17 1 # 17 A 461 ASN B 169 ASN^? 22.23 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 41.06 37.34 -24.45 39.62 36.12 -25.46 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 18 1 # 18 A 461 ASN B 173 ASN^? 23.36 CL CL B 203 coo 5.80 63.03 55.85 5.52 65.03 56.45 41.40 23.51 -28.67 39.71 24.75 -29.04 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 18 hits 1kbk_p00 naa= 1 ULMN 4 1qfw_p00 GONADOTROPIN ALPHA SUBUNIT user 1 4 # 1 A 25 ILE A 78 ILE^? 11.12 O3 SO4 A 201 A 52 ASN B 173 ASN^? 23.36 CL CL B 203 A 53 VAL B 160 VAL^? 19.09 CL CL B 203 A 78 ASN A 73 ASN.? -3.54 O3 SO4 A 201s coo 71.59 -7.22 17.04 71.86 -6.51 15.90 20.35 57.06 -7.82 19.08 56.66 -8.00 coo 81.20 29.47 37.49 79.47 28.44 38.24 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 82.17 24.86 36.27 81.03 23.67 37.80 37.20 24.55 -24.71 36.83 25.47 -26.65 coo 75.27 -4.71 13.39 75.98 -6.45 14.35 27.08 56.20 -4.04 25.99 58.02 -3.77 1qfw_p00 source 1qfw GONADOTROPIN ALPHA SUBUNIT : 1 hits 1qfw_p00 naa= 4 ULMN 3 2p3i_p00 VP4 user 1 3 # 1 A 101 ARG B 110 ARG~? 44.21 CL CL B 203 A 188 TYR B 107 TYR.? 30.85 O4 SO4 B 202 A 190 SER B 109 SER~? 35.44 CL CL B 203 coo 37.69 7.64 13.51 38.82 8.84 16.11 60.95 18.14 -32.42 62.40 18.76 -35.07 coo 47.14 12.10 13.73 48.75 12.33 16.01 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 43.77 6.93 15.46 45.49 7.21 17.11 55.00 17.36 -30.57 53.91 19.30 -31.57 2p3i_p00 source 2p3i VP4 : 1 hits 2p3i_p00 naa= 3 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 # 1 A 270 ASN A 20 ASN.? 21.46 O2 SO4 A 201 A 384 ASN B 173 ASN^? 23.36 CL CL B 203 A 385 GLU B 171 GLU^? 23.59 CL CL B 203 coo 22.28 63.17 110.61 22.47 65.06 111.53 39.64 45.42 -15.90 41.15 44.67 -17.18 coo 7.06 50.07 96.17 8.50 48.54 96.31 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 11.59 49.83 99.41 10.92 47.97 100.16 39.63 28.73 -28.22 38.55 28.71 -30.01 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 # 2 A 270 ASN A 173 ASN.? 27.41 CL CL B 203 A 384 ASN A 128 ASN.? 15.88 O4 SO4 A 201 A 385 GLU A 101 GLU^? 12.83 O4 SO4 A 201 coo 22.28 63.17 110.61 22.47 65.06 111.53 25.34 43.35 -31.46 27.19 42.45 -31.89 coo 7.06 50.07 96.17 8.50 48.54 96.31 23.73 62.15 -16.98 21.71 62.36 -16.27 coo 11.59 49.83 99.41 10.92 47.97 100.16 26.35 58.10 -15.33 27.91 56.97 -16.20 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 3 3 # 3 A 270 ASN A 173 ASN.? 27.41 CL CL B 203 A 384 ASN B 173 ASN^? 23.36 CL CL B 203 A 385 GLU B 171 GLU^? 23.59 CL CL B 203 coo 22.28 63.17 110.61 22.47 65.06 111.53 25.34 43.35 -31.46 27.19 42.45 -31.89 coo 7.06 50.07 96.17 8.50 48.54 96.31 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 11.59 49.83 99.41 10.92 47.97 100.16 39.63 28.73 -28.22 38.55 28.71 -30.01 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 4 3 # 4 A 270 ASN B 13 ASN^? 10.38 CL CL B 203 A 384 ASN A 173 ASN.? 27.41 CL CL B 203 A 385 GLU A 171 GLU^? 26.34 CL CL B 203 coo 22.28 63.17 110.61 22.47 65.06 111.53 37.49 33.73 -11.31 35.37 33.37 -11.20 coo 7.06 50.07 96.17 8.50 48.54 96.31 25.34 43.35 -31.46 27.19 42.45 -31.89 coo 11.59 49.83 99.41 10.92 47.97 100.16 28.18 38.40 -30.98 29.16 38.58 -32.86 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 5 3 # 5 A 270 ASN B 168 ASN.? 28.30 CL CL B 203 A 384 ASN A 173 ASN.? 27.41 CL CL B 203 A 385 GLU A 171 GLU^? 26.34 CL CL B 203 coo 22.28 63.17 110.61 22.47 65.06 111.53 46.24 38.33 -23.56 47.43 39.28 -25.06 coo 7.06 50.07 96.17 8.50 48.54 96.31 25.34 43.35 -31.46 27.19 42.45 -31.89 coo 11.59 49.83 99.41 10.92 47.97 100.16 28.18 38.40 -30.98 29.16 38.58 -32.86 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 6 3 # 6 A 270 ASN B 173 ASN^? 23.36 CL CL B 203 A 384 ASN A 173 ASN.? 27.41 CL CL B 203 A 385 GLU A 171 GLU^? 26.34 CL CL B 203 coo 22.28 63.17 110.61 22.47 65.06 111.53 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 7.06 50.07 96.17 8.50 48.54 96.31 25.34 43.35 -31.46 27.19 42.45 -31.89 coo 11.59 49.83 99.41 10.92 47.97 100.16 28.18 38.40 -30.98 29.16 38.58 -32.86 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 7 3 # 7 A 270 ASN B 173 ASN^? 23.36 CL CL B 203 A 384 ASN B 128 ASN.? 16.24 O2 SO4 B 202 A 385 GLU B 101 GLU^? 13.49 O2 SO4 B 202 coo 22.28 63.17 110.61 22.47 65.06 111.53 41.40 23.51 -28.67 39.71 24.75 -29.04 coo 7.06 50.07 96.17 8.50 48.54 96.31 40.54 4.79 -14.04 42.49 4.20 -13.37 coo 11.59 49.83 99.41 10.92 47.97 100.16 39.44 10.40 -13.31 37.47 11.26 -13.58 2v3r_p00 source 2v3r EXOGLUCANASE 1 : 7 hits 2v3r_p00 naa= 3 ULMN 3 1b01_d00 GENE REGULATION/DNA user 1 3 # 1 B 4 ARG A 148 ARG.? 18.96 CL CL B 203 B 6 THR A 149 THR^? 9.97 CL CL B 203 B 8 THR A 11 THR^? 4.56 CL CL B 203 coo 40.52 16.08 100.90 37.97 16.41 102.60 10.63 29.23 -12.53 8.60 28.94 -10.24 coo 36.11 13.64 95.03 34.54 14.86 95.91 17.06 28.19 -12.48 17.57 26.94 -10.79 coo 32.72 8.05 92.39 31.25 9.11 91.35 24.05 32.29 -10.90 24.73 30.60 -9.78 ULMN 3 1b01_d00 GENE REGULATION/DNA user 2 3 # 2 B 4 ARG A 148 ARG.? 18.96 CL CL B 203 B 6 THR A 149 THR^? 9.97 CL CL B 203 B 8 THR A 151 THR^? 5.27 CL CL B 203 coo 40.52 16.08 100.90 37.97 16.41 102.60 10.63 29.23 -12.53 8.60 28.94 -10.24 coo 36.11 13.64 95.03 34.54 14.86 95.91 17.06 28.19 -12.48 17.57 26.94 -10.79 coo 32.72 8.05 92.39 31.25 9.11 91.35 23.61 29.36 -14.77 24.70 27.83 -13.70 ULMN 3 1b01_d00 GENE REGULATION/DNA user 3 3 # 3 B 4 ARG B 148 ARG.? 33.47 CL CL B 203 B 6 THR B 149 THR^? 27.09 CL CL B 203 B 8 THR B 11 THR^? 18.63 CL CL B 203 coo 40.52 16.08 100.90 37.97 16.41 102.60 58.77 36.06 -9.99 59.77 35.32 -7.22 coo 36.11 13.64 95.03 34.54 14.86 95.91 51.72 37.30 -9.59 51.54 39.31 -8.76 coo 32.72 8.05 92.39 31.25 9.11 91.35 44.15 34.34 -8.16 43.53 36.08 -7.10 ULMN 3 1b01_d00 GENE REGULATION/DNA user 4 3 # 4 B 4 ARG B 148 ARG.? 33.47 CL CL B 203 B 6 THR B 149 THR^? 27.09 CL CL B 203 B 8 THR B 151 THR^? 20.59 CL CL B 203 coo 40.52 16.08 100.90 37.97 16.41 102.60 58.77 36.06 -9.99 59.77 35.32 -7.22 coo 36.11 13.64 95.03 34.54 14.86 95.91 51.72 37.30 -9.59 51.54 39.31 -8.76 coo 32.72 8.05 92.39 31.25 9.11 91.35 45.05 37.16 -12.09 44.11 38.87 -11.18 1b01_d00 source 1b01 GENE REGULATION/DNA : 4 hits 1b01_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 50 TYR~? 16.99 O2 SO4 A 201 I 306 VAL A 102 VAL^? 16.81 O4 SO4 A 201 I 308 VAL A 131 VAL^? 24.55 O4 SO4 A 201 coo 26.18 35.24 6.87 24.33 35.18 8.97 25.15 49.16 -16.65 24.90 50.91 -18.81 coo 23.55 29.53 9.81 23.15 27.39 10.24 20.83 56.85 -16.64 18.74 57.62 -16.45 coo 16.43 30.18 9.35 15.05 30.67 11.01 20.02 54.78 -24.83 18.31 55.89 -25.65 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR B 50 TYR~? 17.17 O4 SO4 B 202 I 306 VAL B 102 VAL^? 17.10 O2 SO4 B 202 I 308 VAL B 131 VAL^? 24.79 O2 SO4 B 202 coo 26.18 35.24 6.87 24.33 35.18 8.97 40.69 17.69 -13.90 40.63 15.92 -16.06 coo 23.55 29.53 9.81 23.15 27.39 10.24 43.98 9.67 -13.71 45.89 8.55 -13.59 coo 16.43 30.18 9.35 15.05 30.67 11.01 45.10 11.48 -21.90 46.67 10.17 -22.71 1cqt_d00 source 1cqt GENE REGULATION/DNA : 2 hits 1cqt_d00 naa= 3 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 1 3 # 1 E 40 ARG A 39 ARG~? 27.60 O2 SO4 A 201 E 41 TYR A 107 TYR.? 29.41 CL CL B 203 E 83 ARG B 43 ARG~? 25.25 O4 SO4 B 202 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 52.54 21.81 -11.81 54.35 23.52 -10.03 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 2 3 # 2 E 40 ARG A 39 ARG~? 27.60 O2 SO4 A 201 E 41 TYR A 107 TYR.? 29.41 CL CL B 203 E 83 ARG B 148 ARG.? 33.47 CL CL B 203 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 12.10 46.09 -25.36 9.95 46.06 -23.57 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 58.77 36.06 -9.99 59.77 35.32 -7.22 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 3 3 # 3 E 40 ARG B 31 ARG^? 34.85 CL CL B 203 E 41 TYR B 8 TYR^? 29.42 CL CL B 203 E 83 ARG A 39 ARG~? 27.60 O2 SO4 A 201 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 9.26 44.73 -19.12 9.60 47.81 -19.09 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 4 3 # 4 E 40 ARG B 39 ARG~? 27.56 O4 SO4 B 202 E 41 TYR B 107 TYR.? 30.85 O4 SO4 B 202 E 83 ARG A 31 ARG^? 24.05 CL CL B 203 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 8.52 36.33 -15.82 6.14 34.93 -17.14 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 5 3 # 5 E 40 ARG B 39 ARG~? 27.56 O4 SO4 B 202 E 41 TYR B 107 TYR.? 30.85 O4 SO4 B 202 E 83 ARG A 43 ARG~? 21.16 CL CL B 203 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 54.19 18.98 -22.56 56.19 18.89 -20.60 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 13.83 43.55 -14.62 12.48 41.53 -12.77 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 6 3 # 6 E 40 ARG B 148 ARG.? 33.47 CL CL B 203 E 41 TYR B 8 TYR^? 29.42 CL CL B 203 E 83 ARG A 39 ARG~? 27.60 O2 SO4 A 201 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 58.77 36.06 -9.99 59.77 35.32 -7.22 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 55.27 31.47 -10.61 57.54 31.62 -12.23 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 9.26 44.73 -19.12 9.60 47.81 -19.09 1id3_d00 source 1id3 STRUCTURAL PROTEIN/DNA : 6 hits 1id3_d00 naa= 3 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 1 3 # 1 A 40 LYS B 94 LYS~? 21.71 O1 SO4 B 202 A 41 LYS B 93 LYS~? 24.54 O1 SO4 B 202 A 42 ILE B 92 ILE~? 24.31 O1 SO4 B 202 coo 36.07 63.73 124.22 32.72 60.75 122.39 51.38 3.18 -10.50 55.68 5.47 -6.55 coo 38.49 66.12 125.64 35.69 66.71 131.25 50.42 1.71 -13.85 51.13 -4.42 -12.40 coo 41.08 63.27 123.17 40.13 62.43 122.44 50.98 4.74 -17.10 50.58 5.08 -18.39 1pyi_d00 source 1pyi PROTEIN (PYRIMIDINE PATHWAY REGULATOR 1) : 1 hits 1pyi_d00 naa= 3 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 1 3 # 1 A1290 LYS A 122 LYS~? 33.55 O4 SO4 A 201 A1294 ASN A 119 ASN~? 31.45 O4 SO4 A 201 A1297 GLU A 89 GLU~? 32.07 O4 SO4 A 201 coo 39.24 18.84-161.99 36.62 21.47-165.99 14.46 65.90 -26.67 9.45 67.99 -27.93 coo 33.53 17.37-161.81 34.31 17.81-163.76 11.73 60.90 -27.86 9.72 60.89 -27.11 coo 29.78 23.31-161.30 31.23 23.66-162.84 7.10 64.61 -22.00 6.35 64.00 -23.92 1xpx_d00 source 1xpx TRANSCRIPTION REGULATION/DNA : 1 hits 1xpx_d00 naa= 3 ULMN 3 2hos_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 5 ARG A 91 ARG~? 21.95 O3 SO4 A 201 A 50 LYS A 122 LYS~? 33.55 O4 SO4 A 201 A 51 ASN A 119 ASN~? 31.45 O4 SO4 A 201 coo 28.68 23.77 42.74 27.76 26.72 42.93 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 14.40 30.33 40.28 14.25 28.31 45.36 14.46 65.90 -26.67 9.45 67.99 -27.93 coo 19.09 30.55 41.51 19.09 28.89 42.82 11.73 60.90 -27.86 9.72 60.89 -27.11 ULMN 3 2hos_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 5 ARG B 91 ARG~? 22.09 O1 SO4 B 202 A 50 LYS B 122 LYS~? 34.58 O2 SO4 B 202 A 51 ASN B 119 ASN~? 31.61 O1 SO4 B 202 coo 28.68 23.77 42.74 27.76 26.72 42.93 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 14.40 30.33 40.28 14.25 28.31 45.36 48.89 -0.01 -23.68 54.40 -1.08 -26.39 coo 19.09 30.55 41.51 19.09 28.89 42.82 52.38 4.31 -25.10 54.19 3.61 -24.21 2hos_d00 source 2hos TRANSCRIPTION/DNA : 2 hits 2hos_d00 naa= 3 ULMN 3 3kmp_d00 TRANSCRIPTION REGULATOR/DNA user 1 3 # 1 A 74 ARG A 91 ARG~? 21.95 O3 SO4 A 201 A 76 GLN A 98 GLN~? 16.84 O3 SO4 A 201 A 81 LYS A 94 LYS~? 22.47 O3 SO4 A 201 coo -17.53 -1.82 -11.90 -18.53 0.50 -13.59 9.44 57.19 -15.50 10.34 55.43 -13.15 coo -11.64 3.92 -10.28 -12.34 5.87 -10.62 15.20 61.96 -8.88 13.57 60.84 -8.08 coo -12.79 -0.17 -12.32 -15.96 3.61 -9.93 12.51 62.07 -13.42 8.27 61.24 -10.02 ULMN 3 3kmp_d00 TRANSCRIPTION REGULATOR/DNA user 2 3 # 2 A 74 ARG B 91 ARG~? 22.09 O1 SO4 B 202 A 76 GLN B 98 GLN~? 16.63 O1 SO4 B 202 A 81 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo -17.53 -1.82 -11.90 -18.53 0.50 -13.59 55.35 7.76 -12.69 54.71 9.63 -10.34 coo -11.64 3.92 -10.28 -12.34 5.87 -10.62 48.85 3.93 -5.97 50.52 5.01 -5.20 coo -12.79 -0.17 -12.32 -15.96 3.61 -9.93 51.38 3.18 -10.50 55.68 5.47 -6.55 3kmp_d00 source 3kmp TRANSCRIPTION REGULATOR/DNA : 2 hits 3kmp_d00 naa= 3 ULMN 3 3pta_d00 TRANSFERASE/DNA user 1 3 # 1 A 682 SER B 121 SER~? 33.32 O2 SO4 B 202 A 683 LYS B 122 LYS~? 34.58 O2 SO4 B 202 A 684 GLN B 125 GLN.? 27.93 O2 SO4 B 202 coo -8.24 -20.23 36.50 -7.44 -18.27 37.68 47.50 0.18 -27.26 49.44 -0.91 -28.24 coo -5.30 -22.52 37.30 -6.47 -26.26 32.30 48.89 -0.01 -23.68 54.40 -1.08 -26.39 coo -3.80 -18.22 38.13 -1.93 -17.88 37.17 45.85 -2.73 -22.14 44.21 -3.87 -22.94 3pta_d00 source 3pta TRANSFERASE/DNA : 1 hits 3pta_d00 naa= 3 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 G 386 ARG A 31 ARG^? 24.05 CL CL B 203 G 387 HIS A 32 HIS.? 29.45 CL CL B 203 G 390 SER A 34 SER.? 29.93 CL CL B 203 coo 93.17 52.97 31.81 95.66 54.71 32.14 8.52 36.33 -15.82 6.14 34.93 -17.14 coo 95.60 53.07 40.31 97.10 52.52 41.67 3.09 41.50 -11.72 1.06 42.02 -11.62 coo 93.25 46.91 38.79 94.12 47.43 36.62 2.32 41.65 -16.48 3.04 43.36 -14.94 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 G 386 ARG A 39 ARG~? 27.60 O2 SO4 A 201 G 387 HIS A 32 HIS.? 29.45 CL CL B 203 G 390 SER A 34 SER.? 29.93 CL CL B 203 coo 93.17 52.97 31.81 95.66 54.71 32.14 9.26 44.73 -19.12 9.60 47.81 -19.09 coo 95.60 53.07 40.31 97.10 52.52 41.67 3.09 41.50 -11.72 1.06 42.02 -11.62 coo 93.25 46.91 38.79 94.12 47.43 36.62 2.32 41.65 -16.48 3.04 43.36 -14.94 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 G 386 ARG B 31 ARG^? 34.85 CL CL B 203 G 387 HIS B 32 HIS.? 32.94 O4 SO4 B 202 G 390 SER B 34 SER.? 32.42 O4 SO4 B 202 coo 93.17 52.97 31.81 95.66 54.71 32.14 59.17 28.21 -12.86 61.91 28.73 -14.07 coo 95.60 53.07 40.31 97.10 52.52 41.67 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 93.25 46.91 38.79 94.12 47.43 36.62 64.42 22.00 -13.52 63.28 20.51 -12.03 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 4 3 # 4 G 386 ARG B 39 ARG~? 27.56 O4 SO4 B 202 G 387 HIS B 32 HIS.? 32.94 O4 SO4 B 202 G 390 SER B 34 SER.? 32.42 O4 SO4 B 202 coo 93.17 52.97 31.81 95.66 54.71 32.14 57.17 19.82 -16.25 56.33 16.88 -15.94 coo 95.60 53.07 40.31 97.10 52.52 41.67 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 93.25 46.91 38.79 94.12 47.43 36.62 64.42 22.00 -13.52 63.28 20.51 -12.03 3qrf_d00 source 3qrf DNA BINDING PROTEIN/DNA : 4 hits 3qrf_d00 naa= 3 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 81 ARG A 91 ARG~? 21.95 O3 SO4 A 201 A 83 GLN A 98 GLN~? 16.84 O3 SO4 A 201 A 88 LYS A 94 LYS~? 22.47 O3 SO4 A 201 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 9.44 57.19 -15.50 10.34 55.43 -13.15 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 15.20 61.96 -8.88 13.57 60.84 -8.08 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 12.51 62.07 -13.42 8.27 61.24 -10.02 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 81 ARG B 91 ARG~? 22.09 O1 SO4 B 202 A 83 GLN B 98 GLN~? 16.63 O1 SO4 B 202 A 88 LYS B 94 LYS~? 21.71 O1 SO4 B 202 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 55.35 7.76 -12.69 54.71 9.63 -10.34 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 48.85 3.93 -5.97 50.52 5.01 -5.20 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 51.38 3.18 -10.50 55.68 5.47 -6.55 3qsv_d00 source 3qsv TRANSCRIPTION/DNA : 2 hits 3qsv_d00 naa= 3 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 21 GLN A 113 GLN~? 36.25 O4 SO4 A 201 A 41 TYR A 133 TYR^? 32.81 O4 SO4 A 201 A 43 ASN A 108 ASN~? 34.79 CL CL B 203 coo 22.03 6.35 12.16 20.71 6.08 10.54 12.00 51.78 -35.73 14.11 52.03 -35.38 coo 18.67 0.21 9.03 16.70 -1.66 8.55 17.01 49.27 -30.66 15.25 47.83 -32.31 coo 14.90 7.30 8.78 14.25 8.14 6.97 8.53 47.32 -28.63 6.99 46.32 -29.72 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 21 GLN B 113 GLN~? 35.97 CL CL B 203 A 41 TYR B 133 TYR^? 31.17 CL CL B 203 A 43 ASN B 108 ASN~? 37.31 O4 SO4 B 202 coo 22.03 6.35 12.16 20.71 6.08 10.54 53.47 13.44 -32.96 51.37 13.63 -32.59 coo 18.67 0.21 9.03 16.70 -1.66 8.55 48.83 16.45 -27.74 50.79 17.58 -29.40 coo 14.90 7.30 8.78 14.25 8.14 6.97 57.24 17.95 -26.18 59.03 17.74 -27.34 3ssc_d00 source 3ssc DNA BINDING PROTEIN/DNA : 2 hits 3ssc_d00 naa= 3 ULMN 4 1a0s_o00 SUCROSE-SPECIFIC PORIN user 1 4 # 1 P 437 ARG A 39 ARG~? 27.60 O2 SO4 A 201 P 439 GLU A 68 GLU.? 23.69 O2 SO4 A 201 P 441 ARG A 43 ARG~? 21.16 CL CL B 203 P 480 GLU A 35 GLU.? 23.66 CL CL B 203 coo -39.15 -21.23 -5.06 -40.81 -23.83 -5.29 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -36.01 -24.08 -5.13 -37.35 -25.76 -5.05 13.06 47.55 -15.25 11.61 49.09 -15.60 coo -34.44 -25.13 -9.10 -37.40 -24.16 -9.24 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -38.47 -19.83 -8.68 -39.93 -21.24 -9.24 8.44 41.65 -17.02 9.96 41.64 -15.52 ULMN 4 1a0s_o00 SUCROSE-SPECIFIC PORIN user 2 4 # 2 P 437 ARG A 43 ARG~? 21.16 CL CL B 203 P 439 GLU A 35 GLU.? 23.66 CL CL B 203 P 441 ARG A 39 ARG~? 27.60 O2 SO4 A 201 P 480 GLU A 68 GLU.? 23.69 O2 SO4 A 201 coo -39.15 -21.23 -5.06 -40.81 -23.83 -5.29 13.83 43.55 -14.62 12.48 41.53 -12.77 coo -36.01 -24.08 -5.13 -37.35 -25.76 -5.05 8.44 41.65 -17.02 9.96 41.64 -15.52 coo -34.44 -25.13 -9.10 -37.40 -24.16 -9.24 9.26 44.73 -19.12 9.60 47.81 -19.09 coo -38.47 -19.83 -8.68 -39.93 -21.24 -9.24 13.06 47.55 -15.25 11.61 49.09 -15.60 1a0s_o00 source 1a0s SUCROSE-SPECIFIC PORIN : 2 hits 1a0s_o00 naa= 4 ULMN 3 2odj_o00 PORIN D user 1 3 # 1 A 156 HIS A 32 HIS.? 29.45 CL CL B 203 A 208 ASP A 65 ASP.? 22.23 O3 SO4 A 201 A 296 SER A 109 SER~? 36.36 CL CL B 203 coo 12.72 17.48 24.71 12.80 19.37 23.81 3.09 41.50 -11.72 1.06 42.02 -11.62 coo 18.47 29.19 29.68 19.30 29.17 27.75 7.01 55.74 -9.90 7.72 56.49 -8.05 coo 6.89 17.22 46.63 5.08 16.21 47.91 11.05 47.60 -32.89 11.53 46.95 -35.16 ULMN 3 2odj_o00 PORIN D user 2 3 # 2 A 156 HIS B 32 HIS.? 32.94 O4 SO4 B 202 A 208 ASP B 65 ASP.? 21.45 O1 SO4 B 202 A 296 SER B 26 SER^? 18.28 CL CL B 203 coo 12.72 17.48 24.71 12.80 19.37 23.81 63.63 22.26 -8.79 65.59 21.52 -8.60 coo 18.47 29.19 29.68 19.30 29.17 27.75 57.62 9.59 -5.23 56.36 8.07 -4.49 coo 6.89 17.22 46.63 5.08 16.21 47.91 44.33 31.26 -4.59 43.54 33.12 -3.25 2odj_o00 source 2ODJ PORIN D : 2 hits 2odj_o00 naa= 3 ULMN 3 2odj_o01 PORIN D user 1 3 # 1 B 156 HIS A 32 HIS.? 29.45 CL CL B 203 B 208 ASP A 65 ASP.? 22.23 O3 SO4 A 201 B 296 SER A 109 SER~? 36.36 CL CL B 203 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 3.09 41.50 -11.72 1.06 42.02 -11.62 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 7.01 55.74 -9.90 7.72 56.49 -8.05 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 11.05 47.60 -32.89 11.53 46.95 -35.16 2odj_o01 source 2ODJ PORIN D : 1 hits 2odj_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU B 171 GLU^? 23.59 CL CL B 203 C 44 ASP B 135 ASP~? 30.33 CL CL B 203 C 50 THR B 175 THR^? 27.98 CL CL B 203 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 39.63 28.73 -28.22 38.55 28.71 -30.01 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 49.61 21.30 -30.64 48.45 23.04 -30.81 coo 25.48 4.87 1.60 23.90 4.95 0.15 42.99 17.23 -27.67 43.89 17.01 -29.61 3hde_o02 source 3HDE LYSOZYME : 1 hits 3hde_o02 naa= 3