*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1bd0_c00 ALANINE RACEMASE user 1 4 # 1 A 39 LYS A 92 LYS~? 15.91 CL CL A 114 A 136 ARG A 25 ARG~? 12.92 C1 GOL A 115 B 265 TYR A 27 TYR~? -3.63 C1 GOL A 115s B 311 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 21.41 16.37 76.24 24.20 16.53 71.48 9.32 -0.83 59.34 13.60 2.28 58.11 coo 31.58 14.01 67.94 28.59 13.31 67.95 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 27.31 16.72 61.73 26.31 15.33 63.93 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 29.07 19.82 67.35 29.90 17.42 66.11 4.86 -2.67 69.49 3.11 -0.86 68.28 1bd0_c00 source 1bd0 ALANINE RACEMASE : 1 hits 1bd0_c00 naa= 4 ULMN 4 1bh2_c00 GUANINE NUCLEOTIDE-BINDING PROTEIN user 1 4 # 1 43 GLU A 46 GLU^? 17.99 O2 GOL A 115 178 ARG B 102 ARG^? 14.15 O2 GOL A 115 181 THR B 103 THR^? 8.74 O2 GOL A 115 204 GLN A 47 GLN.? 16.75 O2 GOL A 115 coo 41.47 -31.24 9.85 43.56 -31.54 10.01 -10.58 9.40 72.08 -11.31 10.55 73.74 coo 41.39 -27.92 12.62 40.37 -30.81 12.72 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 35.15 -30.74 16.68 33.40 -30.14 15.52 -2.26 7.65 74.38 -0.48 8.88 74.34 coo 40.67 -37.01 14.42 40.72 -35.28 13.16 -6.91 9.36 67.07 -6.32 8.53 65.16 1bh2_c00 source 1bh2 GUANINE NUCLEOTIDE-BINDING PROTEIN : 1 hits 1bh2_c00 naa= 4 ULMN 4 1cqj_c00 SUCCINYL-COA SYNTHETASE BETA CHAIN user 1 4 # 1 A 208 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 246 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 109 TYR B 6 TYR^? 13.17 O3 AGOL B 114 B 197 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo 42.05 62.45 76.31 40.18 63.04 75.45 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 37.14 61.56 73.28 37.00 63.65 73.26 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 50.22 35.25 75.17 48.69 37.57 74.89 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 45.03 37.30 75.10 44.89 38.23 76.98 2.66 14.38 76.39 3.95 12.75 76.00 1cqj_c00 source 1cqj SUCCINYL-COA SYNTHETASE BETA CHAIN : 1 hits 1cqj_c00 naa= 4 ULMN 4 1cqj_c01 SUCCINYL-COA SYNTHETASE BETA CHAIN user 1 4 # 1 D 208 GLU A 22 GLU~? 14.62 C1 GOL A 115 D 246 HIS A 90 HIS~? 13.16 C1 GOL A 115 E 109 TYR B 6 TYR^? 13.17 O3 AGOL B 114 E 197 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo -2.91 18.30 76.21 -1.08 17.82 77.32 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 2.87 18.34 77.03 2.47 16.92 78.50 10.26 -5.82 64.75 8.54 -6.13 65.90 coo -1.67 35.94 53.83 -0.91 34.37 56.05 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 1.76 35.71 58.20 0.46 36.19 59.80 2.66 14.38 76.39 3.95 12.75 76.00 1cqj_c01 source 1cqj SUCCINYL-COA SYNTHETASE BETA CHAIN : 1 hits 1cqj_c01 naa= 4 ULMN 4 1hzd_c00 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 # 1 A 141 ALA A 63 ALA^? 8.96 O2 GOL A 115 A 186 GLY A 65 GLY^? 7.74 O1 GOL A 115 A 189 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 209 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 37.84 0.78 41.05 36.64 1.72 41.12 0.68 4.48 67.73 1.38 3.15 67.92 coo 35.09 -2.80 36.98 35.21 -3.54 37.30 7.16 5.92 68.88 6.95 6.74 68.72 coo 31.14 -3.99 35.34 30.92 -2.18 36.39 10.15 10.32 71.63 9.22 11.91 72.68 coo 29.51 -1.57 42.43 30.35 -3.27 41.49 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 4 1hzd_c00 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 2 4 # 2 A 141 ALA B 63 ALA^? 8.86 O2 BGOL B 114 A 186 GLY B 65 GLY^? 7.90 O3 AGOL B 114 A 189 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 209 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 37.84 0.78 41.05 36.64 1.72 41.12 5.28 21.90 67.77 5.16 23.05 68.78 coo 35.09 -2.80 36.98 35.21 -3.54 37.30 2.73 19.42 73.25 2.63 18.67 72.86 coo 31.14 -3.99 35.34 30.92 -2.18 36.39 2.66 14.38 76.39 3.95 12.75 76.00 coo 29.51 -1.57 42.43 30.35 -3.27 41.49 8.17 18.37 77.00 9.28 16.58 76.89 1hzd_c00 source 1hzd AU-BINDING PROTEIN-ENOYL-COA HYDRATASE : 2 hits 1hzd_c00 naa= 4 ULMN 4 1hzd_c01 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 # 1 B 141 ALA A 63 ALA^? 8.96 O2 GOL A 115 B 186 GLY A 65 GLY^? 7.74 O1 GOL A 115 B 189 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 209 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo -8.13 -16.22 36.72 -8.40 -15.53 35.38 0.68 4.48 67.73 1.38 3.15 67.92 coo -1.96 -15.64 35.87 -1.68 -16.38 36.08 7.16 5.92 68.88 6.95 6.74 68.72 coo 1.43 -14.98 33.07 -0.42 -14.67 32.13 10.15 10.32 71.63 9.22 11.91 72.68 coo -4.08 -18.59 28.97 -2.63 -18.97 30.46 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 4 1hzd_c01 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 2 4 # 2 B 141 ALA B 63 ALA^? 8.86 O2 BGOL B 114 B 186 GLY B 65 GLY^? 7.90 O3 AGOL B 114 B 189 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 209 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo -8.13 -16.22 36.72 -8.40 -15.53 35.38 5.28 21.90 67.77 5.16 23.05 68.78 coo -1.96 -15.64 35.87 -1.68 -16.38 36.08 2.73 19.42 73.25 2.63 18.67 72.86 coo 1.43 -14.98 33.07 -0.42 -14.67 32.13 2.66 14.38 76.39 3.95 12.75 76.00 coo -4.08 -18.59 28.97 -2.63 -18.97 30.46 8.17 18.37 77.00 9.28 16.58 76.89 1hzd_c01 source 1hzd AU-BINDING PROTEIN-ENOYL-COA HYDRATASE : 2 hits 1hzd_c01 naa= 4 ULMN 4 1hzd_c02 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 # 1 C 141 ALA A 63 ALA^? 8.96 O2 GOL A 115 C 186 GLY A 65 GLY^? 7.74 O1 GOL A 115 C 189 GLU A 66 GLU^? 10.35 O1 GOL A 115 C 209 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 24.08 -22.10 -0.34 24.67 -20.69 -0.31 0.68 4.48 67.73 1.38 3.15 67.92 coo 21.75 -21.33 5.24 22.01 -22.00 5.60 7.16 5.92 68.88 6.95 6.74 68.72 coo 21.57 -18.82 8.95 22.63 -17.75 7.49 10.15 10.32 71.63 9.22 11.91 72.68 coo 28.83 -17.90 5.95 27.84 -19.51 6.89 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 4 1hzd_c02 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 2 4 # 2 C 141 ALA B 63 ALA^? 8.86 O2 BGOL B 114 C 186 GLY B 65 GLY^? 7.90 O3 AGOL B 114 C 189 GLU B 66 GLU^? 10.26 O3 BGOL B 114 C 209 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 24.08 -22.10 -0.34 24.67 -20.69 -0.31 5.28 21.90 67.77 5.16 23.05 68.78 coo 21.75 -21.33 5.24 22.01 -22.00 5.60 2.73 19.42 73.25 2.63 18.67 72.86 coo 21.57 -18.82 8.95 22.63 -17.75 7.49 2.66 14.38 76.39 3.95 12.75 76.00 coo 28.83 -17.90 5.95 27.84 -19.51 6.89 8.17 18.37 77.00 9.28 16.58 76.89 1hzd_c02 source 1hzd AU-BINDING PROTEIN-ENOYL-COA HYDRATASE : 2 hits 1hzd_c02 naa= 4 ULMN 4 1hzd_c03 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 # 1 D 141 ALA A 63 ALA^? 8.96 O2 GOL A 115 D 186 GLY A 65 GLY^? 7.74 O1 GOL A 115 D 189 GLU A 66 GLU^? 10.35 O1 GOL A 115 D 209 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo -9.83 -0.92 -1.27 -9.83 -1.74 0.02 0.68 4.48 67.73 1.38 3.15 67.92 coo -5.10 2.47 0.73 -5.35 3.21 0.47 7.16 5.92 68.88 6.95 6.74 68.72 coo -2.98 4.12 3.98 -4.11 2.53 4.76 10.15 10.32 71.63 9.22 11.91 72.68 coo -9.98 2.96 6.77 -8.83 4.39 5.71 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 4 1hzd_c03 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 2 4 # 2 D 141 ALA B 63 ALA^? 8.86 O2 BGOL B 114 D 186 GLY B 65 GLY^? 7.90 O3 AGOL B 114 D 189 GLU B 66 GLU^? 10.26 O3 BGOL B 114 D 209 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo -9.83 -0.92 -1.27 -9.83 -1.74 0.02 5.28 21.90 67.77 5.16 23.05 68.78 coo -5.10 2.47 0.73 -5.35 3.21 0.47 2.73 19.42 73.25 2.63 18.67 72.86 coo -2.98 4.12 3.98 -4.11 2.53 4.76 2.66 14.38 76.39 3.95 12.75 76.00 coo -9.98 2.96 6.77 -8.83 4.39 5.71 8.17 18.37 77.00 9.28 16.58 76.89 1hzd_c03 source 1hzd AU-BINDING PROTEIN-ENOYL-COA HYDRATASE : 2 hits 1hzd_c03 naa= 4 ULMN 4 1hzd_c04 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 # 1 E 141 ALA A 63 ALA^? 8.96 O2 GOL A 115 E 186 GLY A 65 GLY^? 7.74 O1 GOL A 115 E 189 GLU A 66 GLU^? 10.35 O1 GOL A 115 E 209 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 2.89 21.88 40.63 4.19 21.12 40.89 0.68 4.48 67.73 1.38 3.15 67.92 coo 2.61 20.08 34.75 2.44 20.78 34.37 7.16 5.92 68.88 6.95 6.74 68.72 coo 4.93 18.46 31.25 6.09 18.34 33.00 10.15 10.32 71.63 9.22 11.91 72.68 coo 10.22 22.22 35.51 8.60 22.81 34.29 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 4 1hzd_c04 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 2 4 # 2 E 141 ALA B 63 ALA^? 8.86 O2 BGOL B 114 E 186 GLY B 65 GLY^? 7.90 O3 AGOL B 114 E 189 GLU B 66 GLU^? 10.26 O3 BGOL B 114 E 209 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 2.89 21.88 40.63 4.19 21.12 40.89 5.28 21.90 67.77 5.16 23.05 68.78 coo 2.61 20.08 34.75 2.44 20.78 34.37 2.73 19.42 73.25 2.63 18.67 72.86 coo 4.93 18.46 31.25 6.09 18.34 33.00 2.66 14.38 76.39 3.95 12.75 76.00 coo 10.22 22.22 35.51 8.60 22.81 34.29 8.17 18.37 77.00 9.28 16.58 76.89 1hzd_c04 source 1hzd AU-BINDING PROTEIN-ENOYL-COA HYDRATASE : 2 hits 1hzd_c04 naa= 4 ULMN 4 1hzd_c05 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 # 1 F 141 ALA A 63 ALA^? 8.96 O2 GOL A 115 F 186 GLY A 65 GLY^? 7.74 O1 GOL A 115 F 189 GLU A 66 GLU^? 10.35 O1 GOL A 115 F 209 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 35.74 16.95 4.24 35.51 15.47 3.99 0.68 4.48 67.73 1.38 3.15 67.92 coo 30.48 17.59 7.15 30.10 18.21 6.83 7.16 5.92 68.88 6.95 6.74 68.72 coo 26.45 15.67 7.87 27.70 14.18 7.03 10.15 10.32 71.63 9.22 11.91 72.68 coo 28.20 13.18 0.91 27.61 14.93 1.92 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 4 1hzd_c05 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 2 4 # 2 F 141 ALA B 63 ALA^? 8.86 O2 BGOL B 114 F 186 GLY B 65 GLY^? 7.90 O3 AGOL B 114 F 189 GLU B 66 GLU^? 10.26 O3 BGOL B 114 F 209 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 35.74 16.95 4.24 35.51 15.47 3.99 5.28 21.90 67.77 5.16 23.05 68.78 coo 30.48 17.59 7.15 30.10 18.21 6.83 2.73 19.42 73.25 2.63 18.67 72.86 coo 26.45 15.67 7.87 27.70 14.18 7.03 2.66 14.38 76.39 3.95 12.75 76.00 coo 28.20 13.18 0.91 27.61 14.93 1.92 8.17 18.37 77.00 9.28 16.58 76.89 1hzd_c05 source 1hzd AU-BINDING PROTEIN-ENOYL-COA HYDRATASE : 2 hits 1hzd_c05 naa= 4 ULMN 4 1i8t_c03 UDP-GALACTOPYRANOSE MUTASE user 1 4 # 1 B 170 ARG A 84 ARG~? 10.06 CL CL A 114 B 278 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 298 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B 348 ASP A 71 ASP~? 16.51 CL CL A 114 coo -8.10 23.98 3.08 -8.58 21.04 2.27 19.14 1.97 63.54 20.03 2.37 60.64 coo -19.09 15.00 16.26 -16.38 15.21 14.84 10.15 17.42 72.76 8.76 14.87 71.71 coo -19.42 16.58 21.15 -18.01 16.20 19.59 8.17 18.37 77.00 9.28 16.58 76.89 coo -3.61 14.95 13.27 -5.31 15.62 12.23 25.70 13.65 72.38 26.87 11.94 72.89 ULMN 4 1i8t_c03 UDP-GALACTOPYRANOSE MUTASE user 2 4 # 2 B 170 ARG B 84 ARG~? 19.95 O3 AGOL B 114 B 278 ARG A 42 ARG^? 5.53 O2 GOL A 115 B 298 GLU A 40 GLU^? -5.26 O1 GOL A 115s B 348 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo -8.10 23.98 3.08 -8.58 21.04 2.27 -8.32 22.59 81.65 -10.97 23.53 80.37 coo -19.09 15.00 16.26 -16.38 15.21 14.84 2.91 6.62 75.93 0.97 5.83 78.22 coo -19.42 16.58 21.15 -18.01 16.20 19.59 7.17 5.83 75.53 6.75 7.34 76.93 coo -3.61 14.95 13.27 -5.31 15.62 12.23 -5.76 9.33 88.77 -5.88 10.77 90.36 1i8t_c03 source 1i8t UDP-GALACTOPYRANOSE MUTASE : 2 hits 1i8t_c03 naa= 4 ULMN 4 1nkk_c01 PEPTIDOMIMETIC INHIBITOR user 1 4 # 1 B 363 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 432 SER B 30 SER~? 7.11 O3 AGOL B 114 B 457 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 465 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 35.32 43.47 -12.43 34.69 42.14 -13.92 0.85 27.13 76.55 -1.16 26.55 76.75 coo 32.38 38.39 -14.73 32.14 40.79 -14.95 1.68 25.09 82.95 3.64 23.84 82.25 coo 40.41 40.81 -13.07 39.42 42.66 -13.07 -1.03 31.78 76.72 0.89 32.00 75.91 coo 27.37 44.86 -17.95 29.55 46.21 -19.65 -8.32 22.59 81.65 -10.97 23.53 80.37 1nkk_c01 source 1nkk PEPTIDOMIMETIC INHIBITOR : 1 hits 1nkk_c01 naa= 4 ULMN 4 1nkk_c02 PEPTIDOMIMETIC INHIBITOR user 1 4 # 1 C1063 HIS B 26 HIS~? 10.11 O3 AGOL B 114 C1132 SER B 30 SER~? 7.11 O3 AGOL B 114 C1157 HIS B 90 HIS~? 13.22 O3 AGOL B 114 C1165 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 35.29 94.34 12.32 34.58 95.70 13.75 0.85 27.13 76.55 -1.16 26.55 76.75 coo 32.69 99.54 14.77 32.37 97.11 14.96 1.68 25.09 82.95 3.64 23.84 82.25 coo 40.55 96.94 13.18 39.34 95.23 13.09 -1.03 31.78 76.72 0.89 32.00 75.91 coo 27.55 93.06 17.78 29.73 91.78 19.50 -8.32 22.59 81.65 -10.97 23.53 80.37 1nkk_c02 source 1nkk PEPTIDOMIMETIC INHIBITOR : 1 hits 1nkk_c02 naa= 4 ULMN 4 1nkk_c03 PEPTIDOMIMETIC INHIBITOR user 1 4 # 1 D1363 HIS B 26 HIS~? 10.11 O3 AGOL B 114 D1432 SER B 30 SER~? 7.11 O3 AGOL B 114 D1457 HIS B 90 HIS~? 13.22 O3 AGOL B 114 D1465 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 11.96 97.36 -12.83 10.34 96.27 -12.07 0.85 27.13 76.55 -1.16 26.55 76.75 coo 8.78 92.76 -9.93 8.91 95.20 -9.86 1.68 25.09 82.95 3.64 23.84 82.25 coo 11.29 94.21 -17.79 11.73 95.91 -16.63 -1.03 31.78 76.72 0.89 32.00 75.91 coo 6.07 100.11 -5.80 4.70 101.59 -8.10 -8.32 22.59 81.65 -10.97 23.53 80.37 1nkk_c03 source 1nkk PEPTIDOMIMETIC INHIBITOR : 1 hits 1nkk_c03 naa= 4 ULMN 4 1o04_c00 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 A 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 A 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 302 SER B 30 SER~? 7.11 O3 AGOL B 114 A 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 85.01 60.31 56.44 83.15 64.89 56.44 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 71.86 54.60 60.61 70.38 53.71 61.84 8.17 18.37 77.00 9.28 16.58 76.89 coo 68.68 62.06 66.08 69.52 59.75 65.97 1.68 25.09 82.95 3.64 23.84 82.25 coo 66.34 67.16 63.84 67.47 65.57 63.06 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c00 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c00 naa= 4 ULMN 4 1o04_c01 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 B 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 B 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B 302 SER B 30 SER~? 7.11 O3 AGOL B 114 B 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 54.45 47.08 36.74 56.53 48.29 32.40 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 67.17 40.71 41.61 68.49 39.13 42.13 8.17 18.37 77.00 9.28 16.58 76.89 coo 70.41 37.34 33.01 69.41 36.86 35.23 1.68 25.09 82.95 3.64 23.84 82.25 coo 73.06 40.82 28.87 71.88 41.23 30.58 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c01 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c01 naa= 4 ULMN 4 1o04_c02 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 C 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 C 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s C 302 SER B 30 SER~? 7.11 O3 AGOL B 114 C 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 83.30 16.28 88.61 85.25 11.75 88.79 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 79.88 15.02 74.11 80.06 15.36 72.02 8.17 18.37 77.00 9.28 16.58 76.89 coo 87.46 9.36 71.39 86.33 11.53 71.37 1.68 25.09 82.95 3.64 23.84 82.25 coo 87.65 3.44 72.32 86.49 4.99 73.13 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c02 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c02 naa= 4 ULMN 4 1o04_c03 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 D 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 D 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s D 302 SER B 30 SER~? 7.11 O3 AGOL B 114 D 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 51.91 3.68 69.52 49.61 2.30 73.71 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 55.94 16.93 75.09 55.86 19.04 75.37 8.17 18.37 77.00 9.28 16.58 76.89 coo 48.09 18.43 80.84 49.40 18.94 78.77 1.68 25.09 82.95 3.64 23.84 82.25 coo 47.32 15.81 86.19 48.62 15.41 84.58 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c03 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c03 naa= 4 ULMN 4 1o04_c04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 E 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 E 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s E 302 SER B 30 SER~? 7.11 O3 AGOL B 114 E 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 52.46 147.49 107.94 50.14 148.75 103.77 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 57.01 134.41 102.36 57.01 132.29 102.10 8.17 18.37 77.00 9.28 16.58 76.89 coo 49.26 132.62 96.59 50.54 132.08 98.67 1.68 25.09 82.95 3.64 23.84 82.25 coo 48.52 135.25 91.24 49.73 135.67 92.87 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c04 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c04 naa= 4 ULMN 4 1o04_c05 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 F 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 F 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s F 302 SER B 30 SER~? 7.11 O3 AGOL B 114 F 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 84.18 136.24 88.80 85.96 140.90 88.66 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 80.72 137.29 103.27 80.90 136.95 105.39 8.17 18.37 77.00 9.28 16.58 76.89 coo 87.99 143.28 106.06 86.95 141.03 106.01 1.68 25.09 82.95 3.64 23.84 82.25 coo 87.94 149.19 105.12 86.87 147.57 104.33 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c05 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c05 naa= 4 ULMN 4 1o04_c06 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 G 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 G 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s G 302 SER B 30 SER~? 7.11 O3 AGOL B 114 G 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 56.79 103.91 140.42 58.85 102.76 144.77 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 69.06 110.82 135.59 70.39 112.47 135.16 8.17 18.37 77.00 9.28 16.58 76.89 coo 72.18 114.35 144.24 71.25 114.81 141.99 1.68 25.09 82.95 3.64 23.84 82.25 coo 75.14 110.89 148.28 73.91 110.46 146.63 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c06 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c06 naa= 4 ULMN 4 1o04_c07 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAuser 1 4 # 1 H 192 LYS B 99 LYS^? 20.46 O2 GOL A 115 H 268 GLU B 40 GLU^? -5.07 O3 BGOL B 114s H 302 SER B 30 SER~? 7.11 O3 AGOL B 114 H 399 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 87.99 92.28 120.76 86.42 87.51 120.70 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 74.53 97.35 116.61 73.03 98.14 115.35 8.17 18.37 77.00 9.28 16.58 76.89 coo 71.83 89.76 111.02 72.57 92.08 111.26 1.68 25.09 82.95 3.64 23.84 82.25 coo 69.74 84.60 113.28 70.77 86.22 114.09 7.99 29.80 81.55 8.79 31.72 80.96 1o04_c07 source 1o04 ALDEHYDE DEHYDROGENASE, MITOCHONDRIAL PRECURSO: 1 hits 1o04_c07 naa= 4 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 140 TYR A 78 TYR~? 10.44 CL CL A 114 B 190 LYS A 70 LYS.? 17.56 C1 AGOL B 114 B 222 ASP A 72 ASP~? 17.54 O2 AGOL B 114 coo 7.17 16.59 41.26 8.01 19.20 40.73 20.68 4.89 66.65 17.95 4.78 66.23 coo 13.38 20.00 35.06 11.43 22.49 39.53 22.34 11.58 74.38 24.39 10.91 80.02 coo 9.76 26.58 38.10 11.63 25.78 38.76 26.30 14.43 67.36 25.07 16.12 67.01 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 B 190 LYS B 70 LYS.? 19.75 O3 BGOL B 114 B 222 ASP B 72 ASP~? 17.82 O3 GOL A 115 coo 7.17 16.59 41.26 8.01 19.20 40.73 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 13.38 20.00 35.06 11.43 22.49 39.53 -1.97 11.40 87.62 0.73 12.09 92.99 coo 9.76 26.58 38.10 11.63 25.78 38.76 -10.25 9.55 86.42 -10.16 8.13 84.85 1a05_c00 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 2 hits 1a05_c00 naa= 3 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 190 LYS A 70 LYS.? 17.56 C1 AGOL B 114 A 222 ASP A 72 ASP~? 17.54 O2 AGOL B 114 B 140 TYR A 78 TYR~? 10.44 CL CL A 114 coo -4.61 20.12 30.34 -2.74 22.65 25.95 22.34 11.58 74.38 24.39 10.91 80.02 coo -1.04 26.60 27.37 -2.94 25.93 26.69 26.30 14.43 67.36 25.07 16.12 67.01 coo 1.51 16.60 24.17 0.82 19.23 24.79 20.68 4.89 66.65 17.95 4.78 66.23 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 190 LYS A 85 LYS~? 9.11 CL CL A 114 A 222 ASP A 82 ASP~? -5.90 CL CL A 114s B 140 TYR A 78 TYR~? 10.44 CL CL A 114 coo -4.61 20.12 30.34 -2.74 22.65 25.95 19.43 -1.95 61.52 24.42 -0.23 58.09 coo -1.04 26.60 27.37 -2.94 25.93 26.69 24.56 -4.97 62.32 26.00 -4.59 60.80 coo 1.51 16.60 24.17 0.82 19.23 24.79 20.68 4.89 66.65 17.95 4.78 66.23 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 3 3 # 3 A 190 LYS B 70 LYS.? 19.75 O3 BGOL B 114 A 222 ASP B 72 ASP~? 17.82 O3 GOL A 115 B 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 coo -4.61 20.12 30.34 -2.74 22.65 25.95 -1.97 11.40 87.62 0.73 12.09 92.99 coo -1.04 26.60 27.37 -2.94 25.93 26.69 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 1.51 16.60 24.17 0.82 19.23 24.79 -6.72 19.79 83.49 -5.56 20.39 81.01 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 4 3 # 4 A 190 LYS B 85 LYS~? 25.09 O3 AGOL B 114 A 222 ASP B 82 ASP~? 25.24 O3 AGOL B 114 B 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 coo -4.61 20.12 30.34 -2.74 22.65 25.95 -9.57 27.75 81.15 -15.18 26.42 83.82 coo -1.04 26.60 27.37 -2.94 25.93 26.69 -11.44 29.55 86.63 -13.55 29.49 86.86 coo 1.51 16.60 24.17 0.82 19.23 24.79 -6.72 19.79 83.49 -5.56 20.39 81.01 1a05_c01 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 4 hits 1a05_c01 naa= 3 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 25 ARG~? 12.92 C1 GOL A 115 265 HIS A 31 HIS~? 8.53 C1 GOL A 115 274 TYR A 6 TYR^? 13.03 O1 GOL A 115 coo -15.18 55.46 8.55 -14.82 52.98 10.38 9.84 -9.08 71.15 12.58 -9.77 72.33 coo -14.48 45.59 11.18 -14.02 47.49 10.42 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 0.94 52.26 9.16 1.95 54.78 9.91 9.35 7.19 64.40 12.10 6.95 63.91 1a41_c01 source 1a41 TOPOISOMERASE I : 1 hits 1a41_c01 naa= 3 ULMN 3 1a65_c00 LACCASE user 1 3 # 1 A 451 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 452 CYH A 23 CYH~? 8.53 O2 GOL A 115 A 453 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 3.92 41.70 29.28 5.16 41.54 27.59 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 2.17 37.54 30.39 0.70 35.33 29.69 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 6.12 36.86 25.94 7.22 37.67 24.36 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1a65_c00 LACCASE user 2 3 # 2 A 451 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 452 CYH B 23 CYH~? 8.19 O2 BGOL B 114 A 453 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 3.92 41.70 29.28 5.16 41.54 27.59 0.85 27.13 76.55 -1.16 26.55 76.75 coo 2.17 37.54 30.39 0.70 35.33 29.69 5.26 28.04 73.57 5.28 26.63 71.09 coo 6.12 36.86 25.94 7.22 37.67 24.36 -1.03 31.78 76.72 0.89 32.00 75.91 1a65_c00 source 1a65 LACCASE : 2 hits 1a65_c00 naa= 3 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 1 3 # 1 A 115 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 125 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 156 LYS A 85 LYS~? 9.11 CL CL A 114 coo 37.11 -19.03 58.81 39.12 -18.07 60.48 11.79 2.97 71.53 9.83 2.65 69.55 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 2 3 # 2 A 115 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 125 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 156 LYS A 92 LYS~? 15.91 CL CL A 114 coo 37.11 -19.03 58.81 39.12 -18.07 60.48 11.79 2.97 71.53 9.83 2.65 69.55 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 3 3 # 3 A 115 TYR B 6 TYR^? 13.17 O3 AGOL B 114 A 125 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 156 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 37.11 -19.03 58.81 39.12 -18.07 60.48 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 0.85 27.13 76.55 -1.16 26.55 76.75 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 -5.61 30.35 71.49 -11.81 30.46 73.02 1a79_c00 source 1a79 TRNA ENDONUCLEASE : 3 hits 1a79_c00 naa= 3 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 1 3 # 1 B 115 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 125 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 156 LYS A 92 LYS~? 15.91 CL CL A 114 coo 52.78 -23.08 19.46 51.79 -21.72 17.22 11.79 2.97 71.53 9.83 2.65 69.55 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 2 3 # 2 B 115 TYR B 6 TYR^? 13.17 O3 AGOL B 114 B 125 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 156 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 52.78 -23.08 19.46 51.79 -21.72 17.22 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 0.85 27.13 76.55 -1.16 26.55 76.75 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 -5.61 30.35 71.49 -11.81 30.46 73.02 1a79_c01 source 1a79 TRNA ENDONUCLEASE : 2 hits 1a79_c01 naa= 3 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 1 3 # 1 C 115 TYR B 6 TYR^? 13.17 O3 AGOL B 114 C 125 HIS B 26 HIS~? 10.11 O3 AGOL B 114 C 156 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 72.53 -8.86 48.33 70.89 -10.65 46.92 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 0.85 27.13 76.55 -1.16 26.55 76.75 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 -5.61 30.35 71.49 -11.81 30.46 73.02 1a79_c02 source 1a79 TRNA ENDONUCLEASE : 1 hits 1a79_c02 naa= 3 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 1 3 # 1 D 115 TYR A 39 TYR^? 6.40 O1 GOL A 115 D 125 HIS A 26 HIS~? 10.00 O1 GOL A 115 D 156 LYS A 92 LYS~? 15.91 CL CL A 114 coo 54.10 1.42 85.16 54.14 4.17 85.62 11.79 2.97 71.53 9.83 2.65 69.55 coo 61.27 5.43 85.32 62.73 6.38 86.49 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 60.28 4.62 76.00 58.35 6.41 80.65 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 2 3 # 2 D 115 TYR B 6 TYR^? 13.17 O3 AGOL B 114 D 125 HIS B 26 HIS~? 10.11 O3 AGOL B 114 D 156 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 54.10 1.42 85.16 54.14 4.17 85.62 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 61.27 5.43 85.32 62.73 6.38 86.49 0.85 27.13 76.55 -1.16 26.55 76.75 coo 60.28 4.62 76.00 58.35 6.41 80.65 -5.61 30.35 71.49 -11.81 30.46 73.02 1a79_c03 source 1a79 TRNA ENDONUCLEASE : 2 hits 1a79_c03 naa= 3 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 1 3 # 1 142 TRP A 87 TRP~? 11.00 O1 GOL A 115 223 ASP A 32 ASP.? 10.78 CL CL A 114 258 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 127.19 33.46 26.14 126.78 36.79 28.15 14.09 -2.53 67.71 14.42 1.36 68.01 coo 126.95 41.66 23.38 128.48 40.72 24.51 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 138.83 37.95 25.17 133.50 36.37 26.52 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 2 3 # 2 142 TRP B 87 TRP~? 10.98 O3 AGOL B 114 223 ASP B 32 ASP.? 14.27 O1 BGOL B 114 258 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 127.19 33.46 26.14 126.78 36.79 28.15 -1.46 27.41 80.24 -1.42 23.56 79.72 coo 126.95 41.66 23.38 128.48 40.72 24.51 0.49 28.13 88.01 2.42 28.83 88.55 coo 138.83 37.95 25.17 133.50 36.37 26.52 3.47 17.87 83.94 8.53 16.31 82.03 1aam_c01 source 1aam ASPARTATE AMINOTRANSFERASE : 2 hits 1aam_c01 naa= 3 ULMN 3 1ab4_c00 GYRASE A user 1 3 # 1 32 ARG A 25 ARG~? 12.92 C1 GOL A 115 78 HIS A 26 HIS~? 10.00 O1 GOL A 115 122 TYR B 6 TYR^? 13.17 O3 AGOL B 114 coo 48.32 72.26 30.89 48.69 69.28 31.53 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 53.63 68.24 34.99 53.08 69.10 33.16 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 75.01 61.87 32.93 75.34 59.26 31.96 -2.31 18.55 72.58 -4.15 18.18 74.66 1ab4_c00 source 1ab4 GYRASE A : 1 hits 1ab4_c00 naa= 3 ULMN 3 1akd_c01 CYTOCHROME P450CAM user 1 3 # 1 252 THR A 93 THR~? 19.76 CL CL A 114 350 PHE A 19 PHE~? 11.77 O2 GOL A 115 357 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 17.85 20.47 14.62 16.85 19.84 12.80 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 7.92 21.96 13.27 8.57 20.30 15.42 -0.32 -2.33 65.65 0.86 0.17 65.52 coo 8.82 20.77 7.90 10.59 19.75 9.80 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1akd_c01 CYTOCHROME P450CAM user 2 3 # 2 252 THR A 103 THR^? 8.58 O2 AGOL B 114 350 PHE A 69 PHE^? 14.10 CL CL A 114 357 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 17.85 20.47 14.62 16.85 19.84 12.80 12.04 17.93 67.84 10.77 16.56 68.93 coo 7.92 21.96 13.27 8.57 20.30 15.42 19.40 9.34 69.57 17.76 7.83 67.92 coo 8.82 20.77 7.90 10.59 19.75 9.80 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1akd_c01 CYTOCHROME P450CAM user 3 3 # 3 252 THR B 93 THR~? 17.37 O3 AGOL B 114 350 PHE B 19 PHE~? 11.52 O2 BGOL B 114 357 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo 17.85 20.47 14.62 16.85 19.84 12.80 -2.97 33.11 71.20 -2.14 34.67 72.49 coo 7.92 21.96 13.27 8.57 20.30 15.42 4.89 28.90 67.24 3.84 26.39 67.76 coo 8.82 20.77 7.90 10.59 19.75 9.80 5.26 28.04 73.57 5.28 26.63 71.09 ULMN 3 1akd_c01 CYTOCHROME P450CAM user 4 3 # 4 252 THR B 103 THR^? 8.74 O2 GOL A 115 350 PHE B 69 PHE^? 14.96 O3 BGOL B 114 357 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 17.85 20.47 14.62 16.85 19.84 12.80 -2.26 7.65 74.38 -0.48 8.88 74.34 coo 7.92 21.96 13.27 8.57 20.30 15.42 -4.08 14.97 83.14 -4.34 16.94 81.21 coo 8.82 20.77 7.90 10.59 19.75 9.80 0.03 16.72 79.11 -1.50 18.92 78.46 1akd_c01 source 1akd CYTOCHROME P450CAM : 4 hits 1akd_c01 naa= 3 ULMN 3 1am5_c04 PEPSIN user 1 3 # 1 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 35 SER B 15 SER~? 17.11 O1 AGOL B 114 215 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo -7.18 8.92 145.10 -8.77 8.81 143.59 9.86 30.83 63.58 9.25 29.72 61.91 coo -12.30 10.35 145.24 -10.75 8.55 145.88 6.70 34.48 63.20 7.42 36.00 64.96 coo -8.20 12.64 138.30 -8.86 10.97 139.38 4.69 24.83 64.29 4.38 25.55 62.31 1am5_c04 source 1am5 PEPSIN : 1 hits 1am5_c04 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 82 ASP~? -5.90 CL CL A 114s 214 ASP A 16 ASP~? 16.03 O2 GOL A 115 289 ASP A 32 ASP.? 10.78 CL CL A 114 coo -0.62 65.95 29.97 0.31 67.47 31.05 24.56 -4.97 62.32 26.00 -4.59 60.80 coo 26.86 59.76 46.36 25.42 58.23 45.92 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 9.42 68.07 30.27 7.35 68.27 30.10 19.63 -5.14 72.66 19.01 -6.45 74.22 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP B 82 ASP~? 25.24 O3 AGOL B 114 214 ASP B 16 ASP~? 15.56 O2 BGOL B 114 289 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo -0.62 65.95 29.97 0.31 67.47 31.05 -11.44 29.55 86.63 -13.55 29.49 86.86 coo 26.86 59.76 46.36 25.42 58.23 45.92 9.86 30.83 63.58 9.25 29.72 61.91 coo 9.42 68.07 30.27 7.35 68.27 30.10 0.49 28.13 88.01 2.42 28.83 88.55 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 2 hits 1amy_c01 naa= 3 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 # 1 E 33 ASP B 16 ASP~? 15.56 O2 BGOL B 114 E 36 SER B 15 SER~? 17.11 O1 AGOL B 114 E 213 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 26.30 12.96 16.78 25.46 12.99 18.72 9.86 30.83 63.58 9.25 29.72 61.91 coo 28.33 15.15 21.27 28.70 13.12 19.97 6.70 34.48 63.20 7.42 36.00 64.96 coo 20.15 16.04 19.79 21.65 14.49 19.86 4.69 24.83 64.29 4.38 25.55 62.31 1apt_c04 source 1apt ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET (LYSTA IS : 1 hits 1apt_c04 naa= 3 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 1 3 # 1 232 HIS A 31 HIS~? 8.53 C1 GOL A 115 254 LYS A 38 LYS^? 8.53 O1 GOL A 115 333 ARG A 84 ARG~? 10.06 CL CL A 114 coo 28.11 -1.15 8.51 29.21 0.63 8.34 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 26.09 4.87 14.60 27.89 3.33 10.26 15.57 5.57 75.60 11.35 8.72 79.21 coo 37.35 7.47 11.84 34.90 6.11 10.60 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 2 3 # 2 232 HIS A 90 HIS~? 13.16 C1 GOL A 115 254 LYS A 92 LYS~? 15.91 CL CL A 114 333 ARG A 84 ARG~? 10.06 CL CL A 114 coo 28.11 -1.15 8.51 29.21 0.63 8.34 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 26.09 4.87 14.60 27.89 3.33 10.26 9.32 -0.83 59.34 13.60 2.28 58.11 coo 37.35 7.47 11.84 34.90 6.11 10.60 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 3 3 # 3 232 HIS B 26 HIS~? 10.11 O3 AGOL B 114 254 LYS B 92 LYS~? 22.65 O3 AGOL B 114 333 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 28.11 -1.15 8.51 29.21 0.63 8.34 0.85 27.13 76.55 -1.16 26.55 76.75 coo 26.09 4.87 14.60 27.89 3.33 10.26 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 37.35 7.47 11.84 34.90 6.11 10.60 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 4 3 # 4 232 HIS B 31 HIS~? 8.39 O3 AGOL B 114 254 LYS B 38 LYS^? 6.81 O3 BGOL B 114 333 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 28.11 -1.15 8.51 29.21 0.63 8.34 5.80 25.06 85.89 7.38 24.42 84.67 coo 26.09 4.87 14.60 27.89 3.33 10.26 3.47 17.87 83.94 8.53 16.31 82.03 coo 37.35 7.47 11.84 34.90 6.11 10.60 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 5 3 # 5 232 HIS B 60 HIS.? 17.24 O2 AGOL B 114 254 LYS B 10 LYS.? 17.18 O2 BGOL B 114 333 ARG B 20 ARG~? 7.55 O1 AGOL B 114 coo 28.11 -1.15 8.51 29.21 0.63 8.34 4.96 22.92 58.66 6.72 23.67 59.53 coo 26.09 4.87 14.60 27.89 3.33 10.26 1.10 28.15 64.50 5.88 30.75 61.34 coo 37.35 7.47 11.84 34.90 6.11 10.60 12.50 29.25 70.09 15.28 27.90 70.29 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 6 3 # 6 232 HIS B 90 HIS~? 13.22 O3 AGOL B 114 254 LYS B 92 LYS~? 22.65 O3 AGOL B 114 333 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 28.11 -1.15 8.51 29.21 0.63 8.34 -1.03 31.78 76.72 0.89 32.00 75.91 coo 26.09 4.87 14.60 27.89 3.33 10.26 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 37.35 7.47 11.84 34.90 6.11 10.60 -8.32 22.59 81.65 -10.97 23.53 80.37 1aq2_c00 source 1aq2 PHOSPHOENOLPYRUVATE CARBOXYKINASE : 6 hits 1aq2_c00 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 20 ARG~? 7.91 O3 GOL A 115 B 342 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 531 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 B 325 ARG A 42 ARG^? 5.53 O2 GOL A 115 B 342 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 531 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 2.91 6.62 75.93 0.97 5.83 78.22 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 B 325 ARG A 102 ARG^? 13.83 O2 AGOL B 114 B 342 ASP A 71 ASP~? 16.51 CL CL A 114 B 531 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 16.77 16.26 64.57 17.43 19.14 63.66 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 25.70 13.65 72.38 26.87 11.94 72.89 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 B 325 ARG A 102 ARG^? 13.83 O2 AGOL B 114 B 342 ASP A 72 ASP~? 17.54 O2 AGOL B 114 B 531 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 16.77 16.26 64.57 17.43 19.14 63.66 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 26.30 14.43 67.36 25.07 16.12 67.01 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 B 325 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 342 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 531 ARG A 102 ARG^? 13.83 O2 AGOL B 114 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 10.15 17.42 72.76 8.76 14.87 71.71 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 4.69 24.83 64.29 4.38 25.55 62.31 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 16.77 16.26 64.57 17.43 19.14 63.66 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 B 325 ARG B 102 ARG^? 14.15 O2 GOL A 115 B 342 ASP B 71 ASP~? 19.48 O2 GOL A 115 B 531 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 7 3 # 7 B 325 ARG B 102 ARG^? 14.15 O2 GOL A 115 B 342 ASP B 72 ASP~? 17.82 O3 GOL A 115 B 531 ARG B 3 ARG^? 7.55 O2 GOL A 115 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 2.10 9.57 79.57 4.68 9.08 78.05 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 7 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 342 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 531 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 2.91 6.62 75.93 0.97 5.83 78.22 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 A 325 ARG A 102 ARG^? 13.83 O2 AGOL B 114 A 342 ASP A 71 ASP~? 16.51 CL CL A 114 A 531 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 16.77 16.26 64.57 17.43 19.14 63.66 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 25.70 13.65 72.38 26.87 11.94 72.89 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 A 325 ARG A 102 ARG^? 13.83 O2 AGOL B 114 A 342 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 531 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 16.77 16.26 64.57 17.43 19.14 63.66 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 4.69 24.83 64.29 4.38 25.55 62.31 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 A 325 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 342 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 531 ARG A 102 ARG^? 13.83 O2 AGOL B 114 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 10.15 17.42 72.76 8.76 14.87 71.71 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 4.69 24.83 64.29 4.38 25.55 62.31 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 16.77 16.26 64.57 17.43 19.14 63.66 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 A 325 ARG B 102 ARG^? 14.15 O2 GOL A 115 A 342 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 531 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 A 325 ARG B 102 ARG^? 14.15 O2 GOL A 115 A 342 ASP B 71 ASP~? 19.48 O2 GOL A 115 A 531 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 2.91 6.62 75.93 0.97 5.83 78.22 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 6 hits 1asy_c01 naa= 3 ULMN 3 1avf_c04 GASTRICSIN user 1 3 # 1 A 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 A 35 SER A 15 SER~? 16.97 O3 GOL A 115 A 217 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo -10.06 2.54 49.69 -8.83 3.73 50.96 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo -11.96 5.74 52.90 -10.55 6.74 51.22 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo -5.22 1.43 56.08 -5.36 2.84 54.49 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1avf_c04 GASTRICSIN user 2 3 # 2 A 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 35 SER B 15 SER~? 17.11 O1 AGOL B 114 A 217 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo -10.06 2.54 49.69 -8.83 3.73 50.96 9.86 30.83 63.58 9.25 29.72 61.91 coo -11.96 5.74 52.90 -10.55 6.74 51.22 6.70 34.48 63.20 7.42 36.00 64.96 coo -5.22 1.43 56.08 -5.36 2.84 54.49 4.69 24.83 64.29 4.38 25.55 62.31 1avf_c04 source 1avf GASTRICSIN : 2 hits 1avf_c04 naa= 3 ULMN 3 1avf_c05 GASTRICSIN user 1 3 # 1 J 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 J 35 SER A 15 SER~? 16.97 O3 GOL A 115 J 217 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1avf_c05 GASTRICSIN user 2 3 # 2 J 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 J 35 SER B 15 SER~? 17.11 O1 AGOL B 114 J 217 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 9.86 30.83 63.58 9.25 29.72 61.91 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 6.70 34.48 63.20 7.42 36.00 64.96 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 4.69 24.83 64.29 4.38 25.55 62.31 1avf_c05 source 1avf GASTRICSIN : 2 hits 1avf_c05 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 101 PHE^? 15.37 O2 AGOL B 114 A 223 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 265 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 39.74 52.86 65.74 41.15 55.14 66.52 7.22 14.91 63.43 4.75 15.06 62.17 coo 30.70 47.50 67.53 29.83 49.47 67.39 4.69 24.83 64.29 4.38 25.55 62.31 coo 19.99 54.53 64.11 20.55 58.78 68.33 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE B 101 PHE^? 15.24 O2 GOL A 115 A 223 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 265 LYS A 92 LYS~? 15.91 CL CL A 114 coo 39.74 52.86 65.74 41.15 55.14 66.52 -3.01 11.87 68.85 -2.57 12.15 66.10 coo 30.70 47.50 67.53 29.83 49.47 67.39 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 19.99 54.53 64.11 20.55 58.78 68.33 9.32 -0.83 59.34 13.60 2.28 58.11 1ax4_c04 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 101 PHE^? 15.37 O2 AGOL B 114 B 223 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 265 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 7.48 54.94 99.62 7.67 52.27 100.42 7.22 14.91 63.43 4.75 15.06 62.17 coo 10.43 61.66 91.81 9.80 60.04 90.61 4.69 24.83 64.29 4.38 25.55 62.31 coo 5.43 58.06 80.08 8.57 53.00 79.37 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE B 101 PHE^? 15.24 O2 GOL A 115 B 223 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 265 LYS A 92 LYS~? 15.91 CL CL A 114 coo 7.48 54.94 99.62 7.67 52.27 100.42 -3.01 11.87 68.85 -2.57 12.15 66.10 coo 10.43 61.66 91.81 9.80 60.04 90.61 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 5.43 58.06 80.08 8.57 53.00 79.37 9.32 -0.83 59.34 13.60 2.28 58.11 1ax4_c05 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 101 PHE^? 15.37 O2 AGOL B 114 C 223 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 265 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo -6.55 73.45 23.60 -6.77 71.48 21.66 7.22 14.91 63.43 4.75 15.06 62.17 coo -9.52 75.74 33.62 -8.85 73.74 33.93 4.69 24.83 64.29 4.38 25.55 62.31 coo -4.44 67.20 42.32 -7.50 62.41 40.49 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE B 101 PHE^? 15.24 O2 GOL A 115 C 223 ASP A 62 ASP.? 15.17 O2 GOL A 115 C 265 LYS A 92 LYS~? 15.91 CL CL A 114 coo -6.55 73.45 23.60 -6.77 71.48 21.66 -3.01 11.87 68.85 -2.57 12.15 66.10 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -4.44 67.20 42.32 -7.50 62.41 40.49 9.32 -0.83 59.34 13.60 2.28 58.11 1ax4_c06 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 101 PHE^? 15.37 O2 AGOL B 114 D 223 ASP B 62 ASP.? 15.08 O2 BGOL B 114 D 265 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo -38.60 55.38 52.70 -40.06 57.72 53.04 7.22 14.91 63.43 4.75 15.06 62.17 coo -29.46 51.67 48.51 -28.63 53.31 49.56 4.69 24.83 64.29 4.38 25.55 62.31 coo -18.87 56.53 54.79 -19.47 62.22 53.03 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE B 101 PHE^? 15.24 O2 GOL A 115 D 223 ASP A 62 ASP.? 15.17 O2 GOL A 115 D 265 LYS A 92 LYS~? 15.91 CL CL A 114 coo -38.60 55.38 52.70 -40.06 57.72 53.04 -3.01 11.87 68.85 -2.57 12.15 66.10 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -18.87 56.53 54.79 -19.47 62.22 53.03 9.32 -0.83 59.34 13.60 2.28 58.11 1ax4_c07 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c07 naa= 3 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 A 140 TRP A 87 TRP~? 11.00 O1 GOL A 115 A 222 ASP A 32 ASP.? 10.78 CL CL A 114 A 258 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 89.83 15.40 0.01 90.61 18.86 1.71 14.09 -2.53 67.71 14.42 1.36 68.01 coo 82.92 20.43 2.47 84.82 20.45 1.55 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 2 3 # 2 A 140 TRP B 87 TRP~? 10.98 O3 AGOL B 114 A 222 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 258 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 89.83 15.40 0.01 90.61 18.86 1.71 -1.46 27.41 80.24 -1.42 23.56 79.72 coo 82.92 20.43 2.47 84.82 20.45 1.55 0.49 28.13 88.01 2.42 28.83 88.55 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 3.47 17.87 83.94 8.53 16.31 82.03 1ay4_c02 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 2 hits 1ay4_c02 naa= 3 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 B 140 TRP A 87 TRP~? 11.00 O1 GOL A 115 B 222 ASP A 32 ASP.? 10.78 CL CL A 114 B 258 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 103.45 44.39 16.20 102.66 41.02 14.32 14.09 -2.53 67.71 14.42 1.36 68.01 coo 110.10 38.66 15.58 108.40 39.41 14.53 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 107.51 45.54 4.76 105.41 44.51 10.25 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 2 3 # 2 B 140 TRP B 87 TRP~? 10.98 O3 AGOL B 114 B 222 ASP B 32 ASP.? 14.27 O1 BGOL B 114 B 258 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 103.45 44.39 16.20 102.66 41.02 14.32 -1.46 27.41 80.24 -1.42 23.56 79.72 coo 110.10 38.66 15.58 108.40 39.41 14.53 0.49 28.13 88.01 2.42 28.83 88.55 coo 107.51 45.54 4.76 105.41 44.51 10.25 3.47 17.87 83.94 8.53 16.31 82.03 1ay4_c03 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 2 hits 1ay4_c03 naa= 3 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 1 3 # 1 A 85 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 171 ARG B 3 ARG^? 7.55 O2 GOL A 115 A 190 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 22.59 2.26 43.22 21.17 3.47 42.27 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 13.63 3.81 28.83 14.49 2.91 31.59 2.10 9.57 79.57 4.68 9.08 78.05 coo 24.97 7.47 37.69 21.24 10.69 35.89 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 2 3 # 2 A 85 HIS A 52 HIS.? 19.33 O3 AGOL B 114 A 171 ARG B 25 ARG~? 13.22 O1 BGOL B 114 A 190 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 22.59 2.26 43.22 21.17 3.47 42.27 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 13.63 3.81 28.83 14.49 2.91 31.59 3.18 34.46 77.89 5.47 36.12 76.56 coo 24.97 7.47 37.69 21.24 10.69 35.89 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 3 3 # 3 A 85 HIS A 60 HIS.? 17.72 O2 GOL A 115 A 171 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 190 LYS A 10 LYS.? 17.78 O2 GOL A 115 coo 22.59 2.26 43.22 21.17 3.47 42.27 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 13.63 3.81 28.83 14.49 2.91 31.59 2.91 6.62 75.93 0.97 5.83 78.22 coo 24.97 7.47 37.69 21.24 10.69 35.89 -0.73 -0.44 61.58 -5.71 -3.55 62.52 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 4 3 # 4 A 85 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 171 ARG A 3 ARG^? 7.23 O2 AGOL B 114 A 190 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 22.59 2.26 43.22 21.17 3.47 42.27 5.80 25.06 85.89 7.38 24.42 84.67 coo 13.63 3.81 28.83 14.49 2.91 31.59 13.50 14.36 73.75 10.91 14.83 75.22 coo 24.97 7.47 37.69 21.24 10.69 35.89 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 5 3 # 5 A 85 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 171 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 190 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 22.59 2.26 43.22 21.17 3.47 42.27 5.80 25.06 85.89 7.38 24.42 84.67 coo 13.63 3.81 28.83 14.49 2.91 31.59 10.15 17.42 72.76 8.76 14.87 71.71 coo 24.97 7.47 37.69 21.24 10.69 35.89 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 6 3 # 6 A 85 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 171 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 190 LYS B 10 LYS.? 17.18 O2 BGOL B 114 coo 22.59 2.26 43.22 21.17 3.47 42.27 4.96 22.92 58.66 6.72 23.67 59.53 coo 13.63 3.81 28.83 14.49 2.91 31.59 10.15 17.42 72.76 8.76 14.87 71.71 coo 24.97 7.47 37.69 21.24 10.69 35.89 1.10 28.15 64.50 5.88 30.75 61.34 1azy_c00 source 1azy THYMIDINE PHOSPHORYLASE : 6 hits 1azy_c00 naa= 3 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 1 3 # 1 B 85 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 171 ARG B 3 ARG^? 7.55 O2 GOL A 115 B 190 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 2.83 4.83 10.84 1.96 4.32 7.97 2.10 9.57 79.57 4.68 9.08 78.05 coo -8.96 9.04 2.88 -5.39 12.11 5.08 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 2 3 # 2 B 85 HIS A 52 HIS.? 19.33 O3 AGOL B 114 B 171 ARG B 25 ARG~? 13.22 O1 BGOL B 114 B 190 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 2.83 4.83 10.84 1.96 4.32 7.97 3.18 34.46 77.89 5.47 36.12 76.56 coo -8.96 9.04 2.88 -5.39 12.11 5.08 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 3 3 # 3 B 85 HIS A 60 HIS.? 17.72 O2 GOL A 115 B 171 ARG A 42 ARG^? 5.53 O2 GOL A 115 B 190 LYS A 10 LYS.? 17.78 O2 GOL A 115 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 2.83 4.83 10.84 1.96 4.32 7.97 2.91 6.62 75.93 0.97 5.83 78.22 coo -8.96 9.04 2.88 -5.39 12.11 5.08 -0.73 -0.44 61.58 -5.71 -3.55 62.52 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 4 3 # 4 B 85 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 171 ARG A 3 ARG^? 7.23 O2 AGOL B 114 B 190 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 5.80 25.06 85.89 7.38 24.42 84.67 coo 2.83 4.83 10.84 1.96 4.32 7.97 13.50 14.36 73.75 10.91 14.83 75.22 coo -8.96 9.04 2.88 -5.39 12.11 5.08 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 5 3 # 5 B 85 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 171 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 190 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 5.80 25.06 85.89 7.38 24.42 84.67 coo 2.83 4.83 10.84 1.96 4.32 7.97 10.15 17.42 72.76 8.76 14.87 71.71 coo -8.96 9.04 2.88 -5.39 12.11 5.08 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 6 3 # 6 B 85 HIS B 60 HIS.? 17.24 O2 AGOL B 114 B 171 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 190 LYS B 10 LYS.? 17.18 O2 BGOL B 114 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 4.96 22.92 58.66 6.72 23.67 59.53 coo 2.83 4.83 10.84 1.96 4.32 7.97 10.15 17.42 72.76 8.76 14.87 71.71 coo -8.96 9.04 2.88 -5.39 12.11 5.08 1.10 28.15 64.50 5.88 30.75 61.34 1azy_c01 source 1azy THYMIDINE PHOSPHORYLASE : 6 hits 1azy_c01 naa= 3 ULMN 3 1b2m_c00 5'-R(*GP*(CH2)U)-3' user 1 3 # 1 A 40 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 58 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 92 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 12.70 27.74 1.76 10.77 27.11 1.24 5.80 25.06 85.89 7.38 24.42 84.67 coo 11.38 23.30 3.20 9.27 23.34 3.13 7.99 29.80 81.55 8.79 31.72 80.96 coo 2.67 19.36 1.56 3.51 21.24 1.94 -1.03 31.78 76.72 0.89 32.00 75.91 1b2m_c00 source 1b2m 5'-R(*GP*(CH2)U)-3' : 1 hits 1b2m_c00 naa= 3 ULMN 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 1 3 # 1 B 40 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 58 GLU A 28 GLU~? 9.11 C3 GOL A 115 B 92 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 10.74 36.24 16.20 9.81 34.52 16.97 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 5.02 36.40 17.74 5.55 34.41 17.37 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 0.68 29.04 20.43 2.46 29.56 19.46 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 2 3 # 2 B 40 HIS A 52 HIS.? 19.33 O3 AGOL B 114 B 58 GLU B 89 GLU~? 21.63 O3 AGOL B 114 B 92 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 10.74 36.24 16.20 9.81 34.52 16.97 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 5.02 36.40 17.74 5.55 34.41 17.37 -9.38 32.01 77.42 -10.46 31.89 75.58 coo 0.68 29.04 20.43 2.46 29.56 19.46 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 3 3 # 3 B 40 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 58 GLU B 28 GLU~? 8.04 O1 BGOL B 114 B 92 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 10.74 36.24 16.20 9.81 34.52 16.97 5.80 25.06 85.89 7.38 24.42 84.67 coo 5.02 36.40 17.74 5.55 34.41 17.37 7.99 29.80 81.55 8.79 31.72 80.96 coo 0.68 29.04 20.43 2.46 29.56 19.46 -1.03 31.78 76.72 0.89 32.00 75.91 1b2m_c01 source 1b2m 5'-R(*GP*(CH2)U)-3' : 3 hits 1b2m_c01 naa= 3 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 # 1 A 18 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 91 ARG A 25 ARG~? 12.92 C1 GOL A 115 A 129 SER A 30 SER~? 7.32 O1 GOL A 115 coo 24.39 47.01 49.70 26.42 47.04 49.21 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 25.98 44.20 42.23 28.53 42.98 43.43 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 30.00 49.76 45.68 28.73 48.72 47.47 15.10 -1.32 71.94 13.61 -0.13 73.45 1b6t_c00 source 1b6t PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE : 1 hits 1b6t_c00 naa= 3 ULMN 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 # 1 B 18 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 91 ARG A 25 ARG~? 12.92 C1 GOL A 115 B 129 SER A 30 SER~? 7.32 O1 GOL A 115 coo 18.19 17.03 40.71 18.55 17.18 38.64 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 25.60 21.10 38.54 23.57 20.93 36.25 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 21.33 14.29 34.62 19.25 14.88 35.71 15.10 -1.32 71.94 13.61 -0.13 73.45 ULMN 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 2 3 # 2 B 18 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 91 ARG B 25 ARG~? 13.22 O1 BGOL B 114 B 129 SER B 30 SER~? 7.11 O3 AGOL B 114 coo 18.19 17.03 40.71 18.55 17.18 38.64 0.85 27.13 76.55 -1.16 26.55 76.75 coo 25.60 21.10 38.54 23.57 20.93 36.25 3.18 34.46 77.89 5.47 36.12 76.56 coo 21.33 14.29 34.62 19.25 14.88 35.71 1.68 25.09 82.95 3.64 23.84 82.25 1b6t_c01 source 1b6t PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE : 2 hits 1b6t_c01 naa= 3 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 A 145 TYR A 75 TYR~? 14.24 CL CL A 114 A 230 ASP A 71 ASP~? 16.51 CL CL A 114 A 273 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 9.23 21.44 106.88 10.18 19.34 105.31 21.81 10.09 65.59 20.00 9.75 63.52 coo 1.45 22.80 104.16 2.58 21.02 104.01 25.70 13.65 72.38 26.87 11.94 72.89 coo 2.97 11.64 107.87 6.59 15.13 107.03 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 A 145 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 230 ASP B 71 ASP~? 19.48 O2 GOL A 115 A 273 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 9.23 21.44 106.88 10.18 19.34 105.31 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 1.45 22.80 104.16 2.58 21.02 104.01 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 2.97 11.64 107.87 6.59 15.13 107.03 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 B 230 ASP A 71 ASP~? 16.51 CL CL A 114 B 273 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 11.81 13.41 73.03 10.00 13.03 75.12 21.81 10.09 65.59 20.00 9.75 63.52 coo 19.17 11.01 76.14 17.26 10.42 76.77 25.70 13.65 72.38 26.87 11.94 72.89 coo 11.10 2.31 76.60 10.24 7.24 75.62 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 B 145 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 230 ASP B 71 ASP~? 19.48 O2 GOL A 115 B 273 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 11.81 13.41 73.03 10.00 13.03 75.12 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 19.17 11.01 76.14 17.26 10.42 76.77 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 11.10 2.31 76.60 10.24 7.24 75.62 3.47 17.87 83.94 8.53 16.31 82.03 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 101 PHE^? 15.37 O2 AGOL B 114 A 159 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 188 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 13.91 34.58 14.67 12.95 36.00 12.47 7.22 14.91 63.43 4.75 15.06 62.17 coo 20.97 28.40 16.26 20.19 30.15 15.34 4.69 24.83 64.29 4.38 25.55 62.31 coo 22.55 41.65 15.60 18.92 37.20 14.63 -4.67 17.57 66.69 -7.33 13.35 64.02 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 1 hits 1b9h_c02 naa= 3 ULMN 3 1bbs_c06 RENIN user 1 3 # 1 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 35 SER A 15 SER~? 16.97 O3 GOL A 115 215 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 61.19 45.85 78.73 62.86 45.48 77.48 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 66.00 46.17 80.29 64.31 47.92 79.91 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 63.61 40.10 74.06 64.05 42.07 74.70 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1bbs_c06 RENIN user 2 3 # 2 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 35 SER B 15 SER~? 17.11 O1 AGOL B 114 215 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 61.19 45.85 78.73 62.86 45.48 77.48 9.86 30.83 63.58 9.25 29.72 61.91 coo 66.00 46.17 80.29 64.31 47.92 79.91 6.70 34.48 63.20 7.42 36.00 64.96 coo 63.61 40.10 74.06 64.05 42.07 74.70 4.69 24.83 64.29 4.38 25.55 62.31 1bbs_c06 source 1bbs RENIN : 2 hits 1bbs_c06 naa= 3 ULMN 3 1bbs_c07 RENIN user 1 3 # 1 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 35 SER A 15 SER~? 16.97 O3 GOL A 115 215 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 61.19 45.85 78.73 62.86 45.48 77.48 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 66.00 46.17 80.29 64.31 47.92 79.91 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 63.61 40.10 74.06 64.05 42.07 74.70 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1bbs_c07 RENIN user 2 3 # 2 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 35 SER B 15 SER~? 17.11 O1 AGOL B 114 215 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 61.19 45.85 78.73 62.86 45.48 77.48 9.86 30.83 63.58 9.25 29.72 61.91 coo 66.00 46.17 80.29 64.31 47.92 79.91 6.70 34.48 63.20 7.42 36.00 64.96 coo 63.61 40.10 74.06 64.05 42.07 74.70 4.69 24.83 64.29 4.38 25.55 62.31 1bbs_c07 source 1bbs RENIN : 2 hits 1bbs_c07 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG B 25 ARG~? 13.22 O1 BGOL B 114 A 141 THR B 18 THR~? 16.12 O1 AGOL B 114 A 235 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo 6.21 93.81 36.58 4.58 96.33 37.17 3.18 34.46 77.89 5.47 36.12 76.56 coo 6.80 92.87 28.33 4.91 92.74 27.40 6.90 34.71 68.43 5.56 36.36 68.22 coo 12.98 90.36 47.57 11.26 89.62 46.62 0.49 28.13 88.01 2.42 28.83 88.55 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG B 25 ARG~? 13.22 O1 BGOL B 114 D 141 THR B 18 THR~? 16.12 O1 AGOL B 114 D 235 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo -8.33 92.80 100.06 -7.71 95.33 98.44 3.18 34.46 77.89 5.47 36.12 76.56 coo -9.24 93.49 108.77 -7.37 94.21 109.61 6.90 34.71 68.43 5.56 36.36 68.22 coo -14.64 87.74 89.51 -12.89 87.43 90.65 0.49 28.13 88.01 2.42 28.83 88.55 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG B 25 ARG~? 13.22 O1 BGOL B 114 C 141 THR B 18 THR~? 16.12 O1 AGOL B 114 C 235 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo -5.79 67.26 36.83 -4.57 64.58 37.74 3.18 34.46 77.89 5.47 36.12 76.56 coo -6.81 68.31 28.28 -4.82 68.47 27.57 6.90 34.71 68.43 5.56 36.36 68.22 coo -13.01 70.96 47.58 -11.44 71.65 46.34 0.49 28.13 88.01 2.42 28.83 88.55 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG B 25 ARG~? 13.22 O1 BGOL B 114 B 141 THR B 18 THR~? 16.12 O1 AGOL B 114 B 235 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo 8.13 67.41 100.27 7.18 68.35 97.45 3.18 34.46 77.89 5.47 36.12 76.56 coo 8.28 67.78 108.81 6.22 67.65 109.43 6.90 34.71 68.43 5.56 36.36 68.22 coo 14.55 73.52 89.47 12.81 73.95 90.56 0.49 28.13 88.01 2.42 28.83 88.55 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c03 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 32 ASP.? 10.78 CL CL A 114 16 HIS A 31 HIS~? 8.53 C1 GOL A 115 67 GLY A 0 GLY.? 9.99 C1 AGOL B 114 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 20.76 18.47 75.10 20.41 17.78 75.41 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP A 32 ASP.? 10.78 CL CL A 114 16 HIS A 31 HIS~? 8.53 C1 GOL A 115 67 GLY A 96 GLY.? 15.65 O1 GOL A 115 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 4.70 0.89 60.28 5.25 0.94 60.81 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 3 3 # 3 14 ASP B 32 ASP.? 14.27 O1 BGOL B 114 16 HIS B 31 HIS~? 8.39 O3 AGOL B 114 67 GLY B 0 GLY.? 11.08 O3 GOL A 115 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 0.49 28.13 88.01 2.42 28.83 88.55 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 5.80 25.06 85.89 7.38 24.42 84.67 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -1.76 4.84 85.68 -1.20 5.45 85.82 1be1_c02 source 1be1 GLUTAMATE MUTASE : 3 hits 1be1_c02 naa= 3 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 1 3 # 1 28 GLU A 22 GLU~? 14.62 C1 GOL A 115 70 HIS A 90 HIS~? 13.16 C1 GOL A 115 281 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 66.09 46.17 155.81 66.77 48.19 155.70 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 69.05 50.55 157.03 68.00 52.29 156.51 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 100.93 36.73 156.02 100.47 38.42 157.18 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 2 3 # 2 28 GLU A 28 GLU~? 9.11 C3 GOL A 115 70 HIS A 31 HIS~? 8.53 C1 GOL A 115 281 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 66.09 46.17 155.81 66.77 48.19 155.70 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 69.05 50.55 157.03 68.00 52.29 156.51 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 100.93 36.73 156.02 100.47 38.42 157.18 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 3 3 # 3 28 GLU B 22 GLU~? 14.39 O1 BGOL B 114 70 HIS B 90 HIS~? 13.22 O3 AGOL B 114 281 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 66.09 46.17 155.81 66.77 48.19 155.70 3.40 33.72 72.05 2.78 34.87 73.76 coo 69.05 50.55 157.03 68.00 52.29 156.51 -1.03 31.78 76.72 0.89 32.00 75.91 coo 100.93 36.73 156.02 100.47 38.42 157.18 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 4 3 # 4 28 GLU B 28 GLU~? 8.04 O1 BGOL B 114 70 HIS B 31 HIS~? 8.39 O3 AGOL B 114 281 HIS A 60 HIS.? 17.72 O2 GOL A 115 coo 66.09 46.17 155.81 66.77 48.19 155.70 7.99 29.80 81.55 8.79 31.72 80.96 coo 69.05 50.55 157.03 68.00 52.29 156.51 5.80 25.06 85.89 7.38 24.42 84.67 coo 100.93 36.73 156.02 100.47 38.42 157.18 -6.29 5.83 61.74 -6.55 4.46 63.31 1bfd_c00 source 1bfd BENZOYLFORMATE DECARBOXYLASE : 4 hits 1bfd_c00 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 503 TYR A 6 TYR^? 13.03 O1 GOL A 115 A 537 GLU A 66 GLU^? 10.35 O1 GOL A 115 coo 24.06 146.21 11.09 22.89 146.18 9.36 7.17 5.83 75.53 6.75 7.34 76.93 coo 15.91 140.69 8.32 15.71 143.39 9.13 9.35 7.19 64.40 12.10 6.95 63.91 coo 16.65 144.44 13.24 18.34 145.22 12.33 10.15 10.32 71.63 9.22 11.91 72.68 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 2 3 # 2 A 461 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 503 TYR A 27 TYR~? -3.63 C1 GOL A 115s A 537 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 24.06 146.21 11.09 22.89 146.18 9.36 10.15 10.32 71.63 9.22 11.91 72.68 coo 15.91 140.69 8.32 15.71 143.39 9.13 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 16.65 144.44 13.24 18.34 145.22 12.33 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 3 3 # 3 A 461 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 503 TYR B 6 TYR^? 13.17 O3 AGOL B 114 A 537 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo 24.06 146.21 11.09 22.89 146.18 9.36 8.17 18.37 77.00 9.28 16.58 76.89 coo 15.91 140.69 8.32 15.71 143.39 9.13 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 16.65 144.44 13.24 18.34 145.22 12.33 2.66 14.38 76.39 3.95 12.75 76.00 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 4 3 # 4 A 461 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 503 TYR B 27 TYR~? -3.70 O3 AGOL B 114s A 537 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 24.06 146.21 11.09 22.89 146.18 9.36 2.66 14.38 76.39 3.95 12.75 76.00 coo 15.91 140.69 8.32 15.71 143.39 9.13 7.36 24.77 79.77 8.81 23.32 81.62 coo 16.65 144.44 13.24 18.34 145.22 12.33 8.17 18.37 77.00 9.28 16.58 76.89 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 4 hits 1bgl_c08 naa= 3 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 # 1 A 451 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 504 TYR A 6 TYR^? 13.03 O1 GOL A 115 A 540 GLU A 66 GLU^? 10.35 O1 GOL A 115 coo 81.34 87.29 87.22 82.36 86.09 88.61 7.17 5.83 75.53 6.75 7.34 76.93 coo 80.85 81.34 94.77 81.70 80.16 92.41 9.35 7.19 64.40 12.10 6.95 63.91 coo 79.94 80.46 88.84 81.11 81.36 87.27 10.15 10.32 71.63 9.22 11.91 72.68 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 2 3 # 2 A 451 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 504 TYR B 6 TYR^? 13.17 O3 AGOL B 114 A 540 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo 81.34 87.29 87.22 82.36 86.09 88.61 8.17 18.37 77.00 9.28 16.58 76.89 coo 80.85 81.34 94.77 81.70 80.16 92.41 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 79.94 80.46 88.84 81.11 81.36 87.27 2.66 14.38 76.39 3.95 12.75 76.00 1bhg_c02 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c02 naa= 3 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 # 1 B 451 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 504 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 540 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 86.52 35.28 112.74 87.08 36.38 110.99 10.15 10.32 71.63 9.22 11.91 72.68 coo 84.93 40.21 105.31 85.72 41.45 107.72 11.79 2.97 71.53 9.83 2.65 69.55 coo 83.38 41.19 112.55 85.47 40.59 112.72 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 2 3 # 2 B 451 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 504 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 540 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 86.52 35.28 112.74 87.08 36.38 110.99 2.66 14.38 76.39 3.95 12.75 76.00 coo 84.93 40.21 105.31 85.72 41.45 107.72 2.56 21.42 79.08 2.05 22.43 76.53 coo 83.38 41.19 112.55 85.47 40.59 112.72 8.17 18.37 77.00 9.28 16.58 76.89 1bhg_c03 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c03 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 3 ARG^? 7.23 O2 AGOL B 114 A 451 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 540 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 79.04 80.20 80.81 79.58 81.40 83.63 13.50 14.36 73.75 10.91 14.83 75.22 coo 81.34 87.29 87.22 82.36 86.09 88.61 2.66 14.38 76.39 3.95 12.75 76.00 coo 79.94 80.46 88.84 81.11 81.36 87.27 8.17 18.37 77.00 9.28 16.58 76.89 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG B 3 ARG^? 7.55 O2 GOL A 115 A 451 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 540 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 79.04 80.20 80.81 79.58 81.40 83.63 2.10 9.57 79.57 4.68 9.08 78.05 coo 81.34 87.29 87.22 82.36 86.09 88.61 10.15 10.32 71.63 9.22 11.91 72.68 coo 79.94 80.46 88.84 81.11 81.36 87.27 7.17 5.83 75.53 6.75 7.34 76.93 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 3 ARG^? 7.23 O2 AGOL B 114 B 451 GLU A 40 GLU^? -5.26 O1 GOL A 115s B 540 GLU A 66 GLU^? 10.35 O1 GOL A 115 coo 82.21 41.07 119.14 83.95 40.66 116.59 13.50 14.36 73.75 10.91 14.83 75.22 coo 86.52 35.28 112.74 87.08 36.38 110.99 7.17 5.83 75.53 6.75 7.34 76.93 coo 83.38 41.19 112.55 85.47 40.59 112.72 10.15 10.32 71.63 9.22 11.91 72.68 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 # 2 B 382 ARG A 3 ARG^? 7.23 O2 AGOL B 114 B 451 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 540 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 82.21 41.07 119.14 83.95 40.66 116.59 13.50 14.36 73.75 10.91 14.83 75.22 coo 86.52 35.28 112.74 87.08 36.38 110.99 2.66 14.38 76.39 3.95 12.75 76.00 coo 83.38 41.19 112.55 85.47 40.59 112.72 8.17 18.37 77.00 9.28 16.58 76.89 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 3 3 # 3 B 382 ARG B 3 ARG^? 7.55 O2 GOL A 115 B 451 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 540 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 82.21 41.07 119.14 83.95 40.66 116.59 2.10 9.57 79.57 4.68 9.08 78.05 coo 86.52 35.28 112.74 87.08 36.38 110.99 10.15 10.32 71.63 9.22 11.91 72.68 coo 83.38 41.19 112.55 85.47 40.59 112.72 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 4 3 # 4 B 382 ARG B 3 ARG^? 7.55 O2 GOL A 115 B 451 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B 540 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo 82.21 41.07 119.14 83.95 40.66 116.59 2.10 9.57 79.57 4.68 9.08 78.05 coo 86.52 35.28 112.74 87.08 36.38 110.99 8.17 18.37 77.00 9.28 16.58 76.89 coo 83.38 41.19 112.55 85.47 40.59 112.72 2.66 14.38 76.39 3.95 12.75 76.00 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 5 3 # 5 B 382 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 451 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 540 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 82.21 41.07 119.14 83.95 40.66 116.59 10.15 17.42 72.76 8.76 14.87 71.71 coo 86.52 35.28 112.74 87.08 36.38 110.99 2.66 14.38 76.39 3.95 12.75 76.00 coo 83.38 41.19 112.55 85.47 40.59 112.72 8.17 18.37 77.00 9.28 16.58 76.89 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 5 hits 1bhg_c05 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG A 84 ARG~? 10.06 CL CL A 114 183 LYS A 92 LYS~? 15.91 CL CL A 114 317 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 76.57 109.19 73.41 73.86 110.26 72.16 19.14 1.97 63.54 20.03 2.37 60.64 coo 82.09 117.51 66.37 80.60 114.32 71.44 9.32 -0.83 59.34 13.60 2.28 58.11 coo 65.21 120.62 58.76 63.62 123.14 59.66 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 2 3 # 2 118 ARG A 84 ARG~? 10.06 CL CL A 114 183 LYS A 99 LYS.? 18.44 CL CL A 114 317 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 76.57 109.19 73.41 73.86 110.26 72.16 19.14 1.97 63.54 20.03 2.37 60.64 coo 82.09 117.51 66.37 80.60 114.32 71.44 10.32 8.81 58.96 14.77 8.28 57.43 coo 65.21 120.62 58.76 63.62 123.14 59.66 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 3 3 # 3 118 ARG A 102 ARG^? 13.83 O2 AGOL B 114 183 LYS A 70 LYS.? 17.56 C1 AGOL B 114 317 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 76.57 109.19 73.41 73.86 110.26 72.16 16.77 16.26 64.57 17.43 19.14 63.66 coo 82.09 117.51 66.37 80.60 114.32 71.44 22.34 11.58 74.38 24.39 10.91 80.02 coo 65.21 120.62 58.76 63.62 123.14 59.66 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 4 3 # 4 118 ARG A 102 ARG^? 13.83 O2 AGOL B 114 183 LYS A 99 LYS.? 18.44 CL CL A 114 317 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 76.57 109.19 73.41 73.86 110.26 72.16 16.77 16.26 64.57 17.43 19.14 63.66 coo 82.09 117.51 66.37 80.60 114.32 71.44 10.32 8.81 58.96 14.77 8.28 57.43 coo 65.21 120.62 58.76 63.62 123.14 59.66 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 5 3 # 5 118 ARG B 84 ARG~? 19.95 O3 AGOL B 114 183 LYS B 70 LYS.? 19.75 O3 BGOL B 114 317 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 76.57 109.19 73.41 73.86 110.26 72.16 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 82.09 117.51 66.37 80.60 114.32 71.44 -1.97 11.40 87.62 0.73 12.09 92.99 coo 65.21 120.62 58.76 63.62 123.14 59.66 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 6 3 # 6 118 ARG B 84 ARG~? 19.95 O3 AGOL B 114 183 LYS B 92 LYS~? 22.65 O3 AGOL B 114 317 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 76.57 109.19 73.41 73.86 110.26 72.16 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 82.09 117.51 66.37 80.60 114.32 71.44 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 65.21 120.62 58.76 63.62 123.14 59.66 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 7 3 # 7 118 ARG B 102 ARG^? 14.15 O2 GOL A 115 183 LYS B 70 LYS.? 19.75 O3 BGOL B 114 317 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 76.57 109.19 73.41 73.86 110.26 72.16 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 82.09 117.51 66.37 80.60 114.32 71.44 -1.97 11.40 87.62 0.73 12.09 92.99 coo 65.21 120.62 58.76 63.62 123.14 59.66 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 8 3 # 8 118 ARG B 102 ARG^? 14.15 O2 GOL A 115 183 LYS B 99 LYS^? 20.46 O2 GOL A 115 317 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo 76.57 109.19 73.41 73.86 110.26 72.16 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 82.09 117.51 66.37 80.60 114.32 71.44 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 65.21 120.62 58.76 63.62 123.14 59.66 13.50 14.36 73.75 10.91 14.83 75.22 1bib_c00 source 1bib BIRA BIFUNCTIONAL PROTEIN (ACTS AS BIOTIN OPER: 8 hits 1bib_c00 naa= 3 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 1 3 # 1 A 102 TRP A 87 TRP~? 11.00 O1 GOL A 115 A 174 ASP A 32 ASP.? 10.78 CL CL A 114 A 198 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 21.59 67.76 35.19 19.10 64.95 36.34 14.09 -2.53 67.71 14.42 1.36 68.01 coo 19.39 73.14 39.98 19.70 71.07 40.14 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 27.94 65.10 43.55 24.20 64.94 40.01 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 2 3 # 2 A 102 TRP B 87 TRP~? 10.98 O3 AGOL B 114 A 174 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 198 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 21.59 67.76 35.19 19.10 64.95 36.34 -1.46 27.41 80.24 -1.42 23.56 79.72 coo 19.39 73.14 39.98 19.70 71.07 40.14 0.49 28.13 88.01 2.42 28.83 88.55 coo 27.94 65.10 43.55 24.20 64.94 40.01 3.47 17.87 83.94 8.53 16.31 82.03 1bjo_c00 source 1bjo PHOSPHOSERINE AMINOTRANSFERASE : 2 hits 1bjo_c00 naa= 3 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 1 3 # 1 A 53 SER A 81 SER~? -3.02 CL CL A 114s A 54 PRO A 34 PRO.? 5.09 CL CL A 114 A 96 ASP A 82 ASP~? -5.90 CL CL A 114s coo -9.03 45.15 44.45 -7.51 43.26 44.28 24.92 -0.43 64.22 23.66 -1.27 66.14 coo -12.82 46.62 43.11 -11.69 44.75 42.79 24.44 -1.13 69.73 23.01 0.36 70.56 coo -5.86 47.39 44.34 -4.55 46.60 42.83 24.56 -4.97 62.32 26.00 -4.59 60.80 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 2 3 # 2 A 53 SER B 81 SER~? 19.76 O3 AGOL B 114 A 54 PRO B 34 PRO.? 17.91 O3 AGOL B 114 A 96 ASP B 82 ASP~? 25.24 O3 AGOL B 114 coo -9.03 45.15 44.45 -7.51 43.26 44.28 -10.56 24.73 86.75 -8.28 25.51 87.05 coo -12.82 46.62 43.11 -11.69 44.75 42.79 -5.64 24.58 89.52 -4.31 23.09 88.47 coo -5.86 47.39 44.34 -4.55 46.60 42.83 -11.44 29.55 86.63 -13.55 29.49 86.86 1boo_c00 source 1boo N-4 CYTOSINE-SPECIFIC METHYLTRANSFERASE PVU II: 2 hits 1boo_c00 naa= 3 ULMN 3 1bqc_c01 BETA-MANNANASE user 1 3 # 1 A 50 ARG A 3 ARG^? 7.23 O2 AGOL B 114 A 128 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 225 GLU A 66 GLU^? 10.35 O1 GOL A 115 coo 38.56 19.11 14.83 37.12 21.00 16.76 13.50 14.36 73.75 10.91 14.83 75.22 coo 36.48 24.43 22.02 36.86 26.34 21.13 7.17 5.83 75.53 6.75 7.34 76.93 coo 40.16 23.71 17.01 38.52 24.96 17.40 10.15 10.32 71.63 9.22 11.91 72.68 ULMN 3 1bqc_c01 BETA-MANNANASE user 2 3 # 2 A 50 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 128 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 225 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 38.56 19.11 14.83 37.12 21.00 16.76 2.91 6.62 75.93 0.97 5.83 78.22 coo 36.48 24.43 22.02 36.86 26.34 21.13 10.15 10.32 71.63 9.22 11.91 72.68 coo 40.16 23.71 17.01 38.52 24.96 17.40 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1bqc_c01 BETA-MANNANASE user 3 3 # 3 A 50 ARG B 3 ARG^? 7.55 O2 GOL A 115 A 128 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 225 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo 38.56 19.11 14.83 37.12 21.00 16.76 2.10 9.57 79.57 4.68 9.08 78.05 coo 36.48 24.43 22.02 36.86 26.34 21.13 8.17 18.37 77.00 9.28 16.58 76.89 coo 40.16 23.71 17.01 38.52 24.96 17.40 2.66 14.38 76.39 3.95 12.75 76.00 ULMN 3 1bqc_c01 BETA-MANNANASE user 4 3 # 4 A 50 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 128 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 225 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 38.56 19.11 14.83 37.12 21.00 16.76 10.15 17.42 72.76 8.76 14.87 71.71 coo 36.48 24.43 22.02 36.86 26.34 21.13 2.66 14.38 76.39 3.95 12.75 76.00 coo 40.16 23.71 17.01 38.52 24.96 17.40 8.17 18.37 77.00 9.28 16.58 76.89 1bqc_c01 source 1bqc BETA-MANNANASE : 4 hits 1bqc_c01 naa= 3 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 A 82 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 168 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 187 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 62.47 12.00 59.65 61.76 10.14 60.31 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 55.10 8.37 73.00 55.48 9.59 70.20 2.91 6.62 75.93 0.97 5.83 78.22 coo 66.76 10.09 66.23 61.80 8.06 65.82 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 A 82 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 168 ARG A 84 ARG~? 10.06 CL CL A 114 A 187 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 62.47 12.00 59.65 61.76 10.14 60.31 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 55.10 8.37 73.00 55.48 9.59 70.20 19.14 1.97 63.54 20.03 2.37 60.64 coo 66.76 10.09 66.23 61.80 8.06 65.82 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 3 3 # 3 A 82 HIS A 52 HIS.? 19.33 O3 AGOL B 114 A 168 ARG B 25 ARG~? 13.22 O1 BGOL B 114 A 187 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 62.47 12.00 59.65 61.76 10.14 60.31 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 55.10 8.37 73.00 55.48 9.59 70.20 3.18 34.46 77.89 5.47 36.12 76.56 coo 66.76 10.09 66.23 61.80 8.06 65.82 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 4 3 # 4 A 82 HIS A 52 HIS.? 19.33 O3 AGOL B 114 A 168 ARG B 25 ARG~? 13.22 O1 BGOL B 114 A 187 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 62.47 12.00 59.65 61.76 10.14 60.31 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 55.10 8.37 73.00 55.48 9.59 70.20 3.18 34.46 77.89 5.47 36.12 76.56 coo 66.76 10.09 66.23 61.80 8.06 65.82 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 5 3 # 5 A 82 HIS A 60 HIS.? 17.72 O2 GOL A 115 A 168 ARG A 20 ARG~? 7.91 O3 GOL A 115 A 187 LYS A 10 LYS.? 17.78 O2 GOL A 115 coo 62.47 12.00 59.65 61.76 10.14 60.31 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 55.10 8.37 73.00 55.48 9.59 70.20 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo 66.76 10.09 66.23 61.80 8.06 65.82 -0.73 -0.44 61.58 -5.71 -3.55 62.52 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 6 3 # 6 A 82 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 168 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 187 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 62.47 12.00 59.65 61.76 10.14 60.31 5.80 25.06 85.89 7.38 24.42 84.67 coo 55.10 8.37 73.00 55.48 9.59 70.20 10.15 17.42 72.76 8.76 14.87 71.71 coo 66.76 10.09 66.23 61.80 8.06 65.82 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 7 3 # 7 A 82 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 168 ARG B 84 ARG~? 19.95 O3 AGOL B 114 A 187 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 62.47 12.00 59.65 61.76 10.14 60.31 5.80 25.06 85.89 7.38 24.42 84.67 coo 55.10 8.37 73.00 55.48 9.59 70.20 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 66.76 10.09 66.23 61.80 8.06 65.82 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 8 3 # 8 A 82 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 168 ARG B 20 ARG~? 7.55 O1 AGOL B 114 A 187 LYS B 10 LYS.? 17.18 O2 BGOL B 114 coo 62.47 12.00 59.65 61.76 10.14 60.31 4.96 22.92 58.66 6.72 23.67 59.53 coo 55.10 8.37 73.00 55.48 9.59 70.20 12.50 29.25 70.09 15.28 27.90 70.29 coo 66.76 10.09 66.23 61.80 8.06 65.82 1.10 28.15 64.50 5.88 30.75 61.34 1brw_c00 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 8 hits 1brw_c00 naa= 3 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 B1082 HIS A 31 HIS~? 8.53 C1 GOL A 115 B1168 ARG A 42 ARG^? 5.53 O2 GOL A 115 B1187 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 35.03 5.72 103.61 36.82 5.00 102.79 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 41.91 5.48 91.85 40.59 6.81 94.28 2.91 6.62 75.93 0.97 5.83 78.22 coo 32.93 -0.12 99.60 37.71 2.39 99.23 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 B1082 HIS A 31 HIS~? 8.53 C1 GOL A 115 B1168 ARG A 84 ARG~? 10.06 CL CL A 114 B1187 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 35.03 5.72 103.61 36.82 5.00 102.79 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 41.91 5.48 91.85 40.59 6.81 94.28 19.14 1.97 63.54 20.03 2.37 60.64 coo 32.93 -0.12 99.60 37.71 2.39 99.23 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 3 3 # 3 B1082 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B1168 ARG B 84 ARG~? 19.95 O3 AGOL B 114 B1187 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 35.03 5.72 103.61 36.82 5.00 102.79 5.80 25.06 85.89 7.38 24.42 84.67 coo 41.91 5.48 91.85 40.59 6.81 94.28 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 32.93 -0.12 99.60 37.71 2.39 99.23 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 4 3 # 4 B1082 HIS B 37 HIS.? 13.44 O3 BGOL B 114 B1168 ARG A 42 ARG^? 5.53 O2 GOL A 115 B1187 LYS B 70 LYS.? 19.75 O3 BGOL B 114 coo 35.03 5.72 103.61 36.82 5.00 102.79 2.31 14.88 87.33 4.16 14.09 87.92 coo 41.91 5.48 91.85 40.59 6.81 94.28 2.91 6.62 75.93 0.97 5.83 78.22 coo 32.93 -0.12 99.60 37.71 2.39 99.23 -1.97 11.40 87.62 0.73 12.09 92.99 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 5 3 # 5 B1082 HIS B 37 HIS.? 13.44 O3 BGOL B 114 B1168 ARG B 84 ARG~? 19.95 O3 AGOL B 114 B1187 LYS B 70 LYS.? 19.75 O3 BGOL B 114 coo 35.03 5.72 103.61 36.82 5.00 102.79 2.31 14.88 87.33 4.16 14.09 87.92 coo 41.91 5.48 91.85 40.59 6.81 94.28 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 32.93 -0.12 99.60 37.71 2.39 99.23 -1.97 11.40 87.62 0.73 12.09 92.99 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 6 3 # 6 B1082 HIS B 60 HIS.? 17.24 O2 AGOL B 114 B1168 ARG B 20 ARG~? 7.55 O1 AGOL B 114 B1187 LYS B 10 LYS.? 17.18 O2 BGOL B 114 coo 35.03 5.72 103.61 36.82 5.00 102.79 4.96 22.92 58.66 6.72 23.67 59.53 coo 41.91 5.48 91.85 40.59 6.81 94.28 12.50 29.25 70.09 15.28 27.90 70.29 coo 32.93 -0.12 99.60 37.71 2.39 99.23 1.10 28.15 64.50 5.88 30.75 61.34 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 7 3 # 7 B1082 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B1168 ARG B 84 ARG~? 19.95 O3 AGOL B 114 B1187 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 35.03 5.72 103.61 36.82 5.00 102.79 -1.03 31.78 76.72 0.89 32.00 75.91 coo 41.91 5.48 91.85 40.59 6.81 94.28 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 32.93 -0.12 99.60 37.71 2.39 99.23 -5.61 30.35 71.49 -11.81 30.46 73.02 1brw_c01 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 7 hits 1brw_c01 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE A 69 PHE^? 14.10 CL CL A 114 A 205 ASP A 32 ASP.? 10.78 CL CL A 114 A 236 LYS A 85 LYS~? 9.11 CL CL A 114 coo 4.14 2.10 36.34 6.69 3.08 36.92 19.40 9.34 69.57 17.76 7.83 67.92 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 2 3 # 2 A 109 PHE A 88 PHE~? 12.60 CL CL A 114 A 205 ASP A 32 ASP.? 10.78 CL CL A 114 A 236 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 4.14 2.10 36.34 6.69 3.08 36.92 15.56 1.39 61.68 15.86 4.02 62.58 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 3 3 # 3 A 109 PHE A 94 PHE~? 17.67 C1 GOL A 115 A 205 ASP A 32 ASP.? 10.78 CL CL A 114 A 236 LYS A 85 LYS~? 9.11 CL CL A 114 coo 4.14 2.10 36.34 6.69 3.08 36.92 6.57 -7.10 61.81 7.33 -9.34 60.30 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 4 3 # 4 A 109 PHE A 101 PHE^? 15.37 O2 AGOL B 114 A 205 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 236 LYS B 10 LYS.? 17.18 O2 BGOL B 114 coo 4.14 2.10 36.34 6.69 3.08 36.92 7.22 14.91 63.43 4.75 15.06 62.17 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 9.86 30.83 63.58 9.25 29.72 61.91 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 1.10 28.15 64.50 5.88 30.75 61.34 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 5 3 # 5 A 109 PHE B 69 PHE^? 14.96 O3 BGOL B 114 A 205 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 236 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 4.14 2.10 36.34 6.69 3.08 36.92 -4.08 14.97 83.14 -4.34 16.94 81.21 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 0.49 28.13 88.01 2.42 28.83 88.55 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 6 3 # 6 A 109 PHE B 88 PHE~? 16.23 O3 AGOL B 114 A 205 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 236 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 4.14 2.10 36.34 6.69 3.08 36.92 -7.55 25.15 77.46 -7.26 22.37 77.78 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 0.49 28.13 88.01 2.42 28.83 88.55 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 7 3 # 7 A 109 PHE B 94 PHE~? 11.42 O3 AGOL B 114 A 205 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 236 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 4.14 2.10 36.34 6.69 3.08 36.92 1.02 29.70 71.33 1.10 27.58 73.12 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 0.49 28.13 88.01 2.42 28.83 88.55 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 -9.57 27.75 81.15 -15.18 26.42 83.82 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 7 hits 1bs0_c01 naa= 3 ULMN 3 1bu7_c02 CYTOCHROME P450 user 1 3 # 1 A 268 THR A 93 THR~? 19.76 CL CL A 114 A 393 PHE A 19 PHE~? 11.77 O2 GOL A 115 A 400 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 45.81 71.19 43.26 47.70 70.19 43.25 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 48.54 63.17 48.16 46.74 64.99 49.22 -0.32 -2.33 65.65 0.86 0.17 65.52 coo 53.76 64.39 46.87 52.06 66.55 47.33 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1bu7_c02 CYTOCHROME P450 user 2 3 # 2 A 268 THR A 103 THR^? 8.58 O2 AGOL B 114 A 393 PHE A 69 PHE^? 14.10 CL CL A 114 A 400 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 45.81 71.19 43.26 47.70 70.19 43.25 12.04 17.93 67.84 10.77 16.56 68.93 coo 48.54 63.17 48.16 46.74 64.99 49.22 19.40 9.34 69.57 17.76 7.83 67.92 coo 53.76 64.39 46.87 52.06 66.55 47.33 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1bu7_c02 CYTOCHROME P450 user 3 3 # 3 A 268 THR B 93 THR~? 17.37 O3 AGOL B 114 A 393 PHE B 19 PHE~? 11.52 O2 BGOL B 114 A 400 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo 45.81 71.19 43.26 47.70 70.19 43.25 -2.97 33.11 71.20 -2.14 34.67 72.49 coo 48.54 63.17 48.16 46.74 64.99 49.22 4.89 28.90 67.24 3.84 26.39 67.76 coo 53.76 64.39 46.87 52.06 66.55 47.33 5.26 28.04 73.57 5.28 26.63 71.09 ULMN 3 1bu7_c02 CYTOCHROME P450 user 4 3 # 4 A 268 THR B 103 THR^? 8.74 O2 GOL A 115 A 393 PHE B 69 PHE^? 14.96 O3 BGOL B 114 A 400 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 45.81 71.19 43.26 47.70 70.19 43.25 -2.26 7.65 74.38 -0.48 8.88 74.34 coo 48.54 63.17 48.16 46.74 64.99 49.22 -4.08 14.97 83.14 -4.34 16.94 81.21 coo 53.76 64.39 46.87 52.06 66.55 47.33 0.03 16.72 79.11 -1.50 18.92 78.46 1bu7_c02 source 1bu7 CYTOCHROME P450 : 4 hits 1bu7_c02 naa= 3 ULMN 3 1bu7_c03 CYTOCHROME P450 user 1 3 # 1 B 268 THR A 93 THR~? 19.76 CL CL A 114 B 393 PHE A 19 PHE~? 11.77 O2 GOL A 115 B 400 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 37.20 116.32 52.00 35.18 117.07 52.13 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 33.81 121.65 59.26 35.49 119.55 59.81 -0.32 -2.33 65.65 0.86 0.17 65.52 coo 28.79 121.15 57.00 30.51 118.99 56.70 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1bu7_c03 CYTOCHROME P450 user 2 3 # 2 B 268 THR A 103 THR^? 8.58 O2 AGOL B 114 B 393 PHE A 69 PHE^? 14.10 CL CL A 114 B 400 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 37.20 116.32 52.00 35.18 117.07 52.13 12.04 17.93 67.84 10.77 16.56 68.93 coo 33.81 121.65 59.26 35.49 119.55 59.81 19.40 9.34 69.57 17.76 7.83 67.92 coo 28.79 121.15 57.00 30.51 118.99 56.70 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1bu7_c03 CYTOCHROME P450 user 3 3 # 3 B 268 THR B 93 THR~? 17.37 O3 AGOL B 114 B 393 PHE B 19 PHE~? 11.52 O2 BGOL B 114 B 400 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo 37.20 116.32 52.00 35.18 117.07 52.13 -2.97 33.11 71.20 -2.14 34.67 72.49 coo 33.81 121.65 59.26 35.49 119.55 59.81 4.89 28.90 67.24 3.84 26.39 67.76 coo 28.79 121.15 57.00 30.51 118.99 56.70 5.26 28.04 73.57 5.28 26.63 71.09 ULMN 3 1bu7_c03 CYTOCHROME P450 user 4 3 # 4 B 268 THR B 103 THR^? 8.74 O2 GOL A 115 B 393 PHE B 69 PHE^? 14.96 O3 BGOL B 114 B 400 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 37.20 116.32 52.00 35.18 117.07 52.13 -2.26 7.65 74.38 -0.48 8.88 74.34 coo 33.81 121.65 59.26 35.49 119.55 59.81 -4.08 14.97 83.14 -4.34 16.94 81.21 coo 28.79 121.15 57.00 30.51 118.99 56.70 0.03 16.72 79.11 -1.50 18.92 78.46 1bu7_c03 source 1bu7 CYTOCHROME P450 : 4 hits 1bu7_c03 naa= 3 ULMN 3 1c54_c00 RIBONUCLEASE SA user 1 3 # 1 A 54 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 65 ARG A 3 ARG^? 7.23 O2 AGOL B 114 A 85 HIS A 37 HIS.? 13.87 O1 GOL A 115 coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 7.17 5.83 75.53 6.75 7.34 76.93 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 13.50 14.36 73.75 10.91 14.83 75.22 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 19.30 8.07 76.97 19.38 8.41 79.04 ULMN 3 1c54_c00 RIBONUCLEASE SA user 2 3 # 2 A 54 GLU A 89 GLU~? 16.58 CL CL A 114 A 65 ARG A 84 ARG~? 10.06 CL CL A 114 A 85 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 13.52 -6.00 58.57 12.62 -5.23 56.79 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 19.14 1.97 63.54 20.03 2.37 60.64 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1c54_c00 RIBONUCLEASE SA user 3 3 # 3 A 54 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 65 ARG B 3 ARG^? 7.55 O2 GOL A 115 A 85 HIS B 37 HIS.? 13.44 O3 BGOL B 114 coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 8.17 18.37 77.00 9.28 16.58 76.89 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 2.10 9.57 79.57 4.68 9.08 78.05 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 2.31 14.88 87.33 4.16 14.09 87.92 1c54_c00 source 1c54 RIBONUCLEASE SA : 3 hits 1c54_c00 naa= 3 ULMN 3 1c82_c01 HYALURONATE LYASE user 1 3 # 1 A 399 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 408 TYR A 27 TYR~? -3.63 C1 GOL A 115s A 462 ARG A 25 ARG~? 12.92 C1 GOL A 115 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 10.34 -11.56 38.02 10.61 -11.96 35.00 9.84 -9.08 71.15 12.58 -9.77 72.33 1c82_c01 source 1c82 HYALURONATE LYASE : 1 hits 1c82_c01 naa= 3 ULMN 3 1c82_c02 HYALURONATE LYASE user 1 3 # 1 A 399 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 408 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 480 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 11.79 2.97 71.53 9.83 2.65 69.55 coo -6.46 -13.31 26.85 -4.21 -11.25 27.13 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1c82_c02 HYALURONATE LYASE user 2 3 # 2 A 399 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 408 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 480 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 0.85 27.13 76.55 -1.16 26.55 76.75 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 2.56 21.42 79.08 2.05 22.43 76.53 coo -6.46 -13.31 26.85 -4.21 -11.25 27.13 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1c82_c02 HYALURONATE LYASE user 3 3 # 3 A 399 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 408 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 480 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 0.85 27.13 76.55 -1.16 26.55 76.75 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 2.56 21.42 79.08 2.05 22.43 76.53 coo -6.46 -13.31 26.85 -4.21 -11.25 27.13 -7.93 9.11 76.54 -9.19 6.36 75.80 1c82_c02 source 1c82 HYALURONATE LYASE : 3 hits 1c82_c02 naa= 3 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 # 1 A 14 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 16 HIS A 60 HIS.? 17.72 O2 GOL A 115 A 67 GLY A 96 GLY.? 15.65 O1 GOL A 115 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 4.70 0.89 60.28 5.25 0.94 60.81 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 # 2 A 14 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 16 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 67 GLY B 96 GLY.? 18.83 O3 AGOL B 114 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 4.69 24.83 64.29 4.38 25.55 62.31 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 4.96 22.92 58.66 6.72 23.67 59.53 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 -3.86 28.13 64.96 -3.78 27.40 65.39 1cb7_c06 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c06 naa= 3 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 # 1 C 14 ASP A 62 ASP.? 15.17 O2 GOL A 115 C 16 HIS A 60 HIS.? 17.72 O2 GOL A 115 C 67 GLY A 96 GLY.? 15.65 O1 GOL A 115 coo 10.04 44.27 88.44 9.47 42.32 89.03 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 6.38 39.80 88.71 6.88 38.89 86.87 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 17.63 42.50 89.25 18.11 42.29 88.64 4.70 0.89 60.28 5.25 0.94 60.81 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 # 2 C 14 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 16 HIS B 60 HIS.? 17.24 O2 AGOL B 114 C 67 GLY B 96 GLY.? 18.83 O3 AGOL B 114 coo 10.04 44.27 88.44 9.47 42.32 89.03 4.69 24.83 64.29 4.38 25.55 62.31 coo 6.38 39.80 88.71 6.88 38.89 86.87 4.96 22.92 58.66 6.72 23.67 59.53 coo 17.63 42.50 89.25 18.11 42.29 88.64 -3.86 28.13 64.96 -3.78 27.40 65.39 1cb7_c07 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c07 naa= 3 ULMN 3 1cb8_c01 CHONDROITINASE AC user 1 3 # 1 A 225 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 234 TYR A 27 TYR~? -3.63 C1 GOL A 115s A 288 ARG A 25 ARG~? 12.92 C1 GOL A 115 coo 27.04 28.61 41.75 26.86 28.65 43.84 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 21.80 30.48 43.67 23.70 29.06 45.12 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 24.79 22.62 45.60 24.87 25.42 46.81 9.84 -9.08 71.15 12.58 -9.77 72.33 1cb8_c01 source 1cb8 CHONDROITINASE AC : 1 hits 1cb8_c01 naa= 3 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 1 3 # 1 71 ARG A 3 ARG^? 7.23 O2 AGOL B 114 127 ARG B 42 ARG^? 8.41 O2 AGOL B 114 270 GLU B 46 GLU^? 18.15 O2 AGOL B 114 coo -0.83 25.63 1.57 0.97 28.05 0.90 13.50 14.36 73.75 10.91 14.83 75.22 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 10.15 17.42 72.76 8.76 14.87 71.71 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 14.18 17.59 59.29 15.88 16.34 59.02 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 2 3 # 2 71 ARG A 42 ARG^? 5.53 O2 GOL A 115 127 ARG B 3 ARG^? 7.55 O2 GOL A 115 270 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo -0.83 25.63 1.57 0.97 28.05 0.90 2.91 6.62 75.93 0.97 5.83 78.22 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 2.10 9.57 79.57 4.68 9.08 78.05 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 8.17 18.37 77.00 9.28 16.58 76.89 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 3 3 # 3 71 ARG B 3 ARG^? 7.55 O2 GOL A 115 127 ARG A 42 ARG^? 5.53 O2 GOL A 115 270 GLU A 46 GLU^? 17.99 O2 GOL A 115 coo -0.83 25.63 1.57 0.97 28.05 0.90 2.10 9.57 79.57 4.68 9.08 78.05 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 2.91 6.62 75.93 0.97 5.83 78.22 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 -10.58 9.40 72.08 -11.31 10.55 73.74 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 4 3 # 4 71 ARG B 3 ARG^? 7.55 O2 GOL A 115 127 ARG A 42 ARG^? 5.53 O2 GOL A 115 270 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo -0.83 25.63 1.57 0.97 28.05 0.90 2.10 9.57 79.57 4.68 9.08 78.05 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 2.91 6.62 75.93 0.97 5.83 78.22 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 8.17 18.37 77.00 9.28 16.58 76.89 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 5 3 # 5 71 ARG B 42 ARG^? 8.41 O2 AGOL B 114 127 ARG A 3 ARG^? 7.23 O2 AGOL B 114 270 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo -0.83 25.63 1.57 0.97 28.05 0.90 10.15 17.42 72.76 8.76 14.87 71.71 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 13.50 14.36 73.75 10.91 14.83 75.22 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 7.17 5.83 75.53 6.75 7.34 76.93 1cbx_c01 source 1cbx CARBOXYPEPTIDASE A (E.C.3.4.17.1) COMPLEX WITH: 5 hits 1cbx_c01 naa= 3 ULMN 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 A 232 HIS A 37 HIS.? 13.87 O1 GOL A 115 A 262 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 358 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 26.19 60.87 43.98 27.48 59.27 43.30 19.30 8.07 76.97 19.38 8.41 79.04 coo 27.13 54.07 50.45 26.96 54.19 48.35 10.15 10.32 71.63 9.22 11.91 72.68 coo 27.06 50.43 44.36 27.99 52.27 44.74 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 # 2 A 232 HIS B 37 HIS.? 13.44 O3 BGOL B 114 A 262 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 358 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 26.19 60.87 43.98 27.48 59.27 43.30 2.31 14.88 87.33 4.16 14.09 87.92 coo 27.13 54.07 50.45 26.96 54.19 48.35 2.66 14.38 76.39 3.95 12.75 76.00 coo 27.06 50.43 44.36 27.99 52.27 44.74 8.17 18.37 77.00 9.28 16.58 76.89 1chm_c00 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 2 hits 1chm_c00 naa= 3 ULMN 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 B 232 HIS A 37 HIS.? 13.87 O1 GOL A 115 B 262 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 358 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 44.98 77.01 48.39 44.42 78.67 47.18 19.30 8.07 76.97 19.38 8.41 79.04 coo 41.60 83.57 54.16 42.46 83.24 52.25 10.15 10.32 71.63 9.22 11.91 72.68 coo 44.05 87.61 48.73 43.15 85.67 48.52 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 # 2 B 232 HIS B 37 HIS.? 13.44 O3 BGOL B 114 B 262 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 358 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 44.98 77.01 48.39 44.42 78.67 47.18 2.31 14.88 87.33 4.16 14.09 87.92 coo 41.60 83.57 54.16 42.46 83.24 52.25 2.66 14.38 76.39 3.95 12.75 76.00 coo 44.05 87.61 48.73 43.15 85.67 48.52 8.17 18.37 77.00 9.28 16.58 76.89 1chm_c01 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 2 hits 1chm_c01 naa= 3 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 A 198 GLY A 13 GLY.? 22.56 O2 GOL A 115 A 228 SER A 15 SER~? 16.97 O3 GOL A 115 A 549 ASP A 16 ASP~? 16.03 O2 GOL A 115 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 -3.15 -7.64 57.16 -3.10 -7.17 57.77 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -6.36 -4.07 67.12 -7.21 -2.58 65.89 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 A 198 GLY B 13 GLY.? 22.36 O2 BGOL B 114 A 228 SER B 15 SER~? 17.11 O1 AGOL B 114 A 549 ASP B 16 ASP~? 15.56 O2 BGOL B 114 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 1.15 35.11 59.81 1.25 34.57 60.37 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 6.70 34.48 63.20 7.42 36.00 64.96 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 9.86 30.83 63.58 9.25 29.72 61.91 1cjy_c00 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 2 hits 1cjy_c00 naa= 3 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 B1198 GLY A 13 GLY.? 22.56 O2 GOL A 115 B1228 SER A 15 SER~? 16.97 O3 GOL A 115 B1549 ASP A 16 ASP~? 16.03 O2 GOL A 115 coo 126.34 72.75 125.66 125.95 73.27 126.11 -3.15 -7.64 57.16 -3.10 -7.17 57.77 coo 131.65 74.68 129.41 130.31 72.73 128.82 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 134.72 69.43 130.42 133.03 70.65 130.08 -6.36 -4.07 67.12 -7.21 -2.58 65.89 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 B1198 GLY B 13 GLY.? 22.36 O2 BGOL B 114 B1228 SER B 15 SER~? 17.11 O1 AGOL B 114 B1549 ASP B 16 ASP~? 15.56 O2 BGOL B 114 coo 126.34 72.75 125.66 125.95 73.27 126.11 1.15 35.11 59.81 1.25 34.57 60.37 coo 131.65 74.68 129.41 130.31 72.73 128.82 6.70 34.48 63.20 7.42 36.00 64.96 coo 134.72 69.43 130.42 133.03 70.65 130.08 9.86 30.83 63.58 9.25 29.72 61.91 1cjy_c01 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 2 hits 1cjy_c01 naa= 3 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 1 3 # 1 34 ASP A 16 ASP~? 16.03 O2 GOL A 115 37 SER A 15 SER~? 16.97 O3 GOL A 115 216 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 16.90 26.20 29.49 16.22 24.50 28.41 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 12.23 24.31 30.40 14.55 23.96 31.03 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 13.93 25.52 22.10 14.75 24.44 23.75 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 2 3 # 2 34 ASP B 16 ASP~? 15.56 O2 BGOL B 114 37 SER B 15 SER~? 17.11 O1 AGOL B 114 216 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 16.90 26.20 29.49 16.22 24.50 28.41 9.86 30.83 63.58 9.25 29.72 61.91 coo 12.23 24.31 30.40 14.55 23.96 31.03 6.70 34.48 63.20 7.42 36.00 64.96 coo 13.93 25.52 22.10 14.75 24.44 23.75 4.69 24.83 64.29 4.38 25.55 62.31 1cms_c04 source 1cms CHYMOSIN B (FORMERLY KNOWN AS RENNIN) (E.C.3.4: 2 hits 1cms_c04 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 89 GLU A 17 GLU~? 11.95 O3 GOL A 115 A 120 SER A 15 SER~? 16.97 O3 GOL A 115 coo -24.35 9.53 67.64 -25.07 11.29 68.60 3.69 -7.10 65.54 5.12 -8.60 65.19 coo -31.18 6.91 75.60 -32.39 8.51 74.91 -5.33 -8.56 70.68 -3.96 -7.90 72.21 coo -34.73 8.57 68.21 -33.63 9.08 70.28 -5.12 -7.38 63.82 -4.66 -9.00 65.56 ULMN 3 1cns_c00 CHITINASE user 2 3 # 2 A 67 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 89 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 120 SER A 30 SER~? 7.32 O1 GOL A 115 coo -24.35 9.53 67.64 -25.07 11.29 68.60 7.17 5.83 75.53 6.75 7.34 76.93 coo -31.18 6.91 75.60 -32.39 8.51 74.91 9.84 -6.23 75.42 9.01 -8.17 75.63 coo -34.73 8.57 68.21 -33.63 9.08 70.28 15.10 -1.32 71.94 13.61 -0.13 73.45 ULMN 3 1cns_c00 CHITINASE user 3 3 # 3 A 67 GLU B 22 GLU~? 14.39 O1 BGOL B 114 A 89 GLU B 17 GLU~? 13.61 O1 AGOL B 114 A 120 SER B 15 SER~? 17.11 O1 AGOL B 114 coo -24.35 9.53 67.64 -25.07 11.29 68.60 3.40 33.72 72.05 2.78 34.87 73.76 coo -31.18 6.91 75.60 -32.39 8.51 74.91 11.50 35.87 67.45 13.35 35.01 67.92 coo -34.73 8.57 68.21 -33.63 9.08 70.28 6.70 34.48 63.20 7.42 36.00 64.96 ULMN 3 1cns_c00 CHITINASE user 4 3 # 4 A 67 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 89 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 120 SER B 30 SER~? 7.11 O3 AGOL B 114 coo -24.35 9.53 67.64 -25.07 11.29 68.60 8.17 18.37 77.00 9.28 16.58 76.89 coo -31.18 6.91 75.60 -32.39 8.51 74.91 7.99 29.80 81.55 8.79 31.72 80.96 coo -34.73 8.57 68.21 -33.63 9.08 70.28 1.68 25.09 82.95 3.64 23.84 82.25 1cns_c00 source 1cns CHITINASE : 4 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 40 GLU^? -5.26 O1 GOL A 115s B 89 GLU A 28 GLU~? 9.11 C3 GOL A 115 B 120 SER A 30 SER~? 7.32 O1 GOL A 115 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 7.17 5.83 75.53 6.75 7.34 76.93 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 15.10 -1.32 71.94 13.61 -0.13 73.45 ULMN 3 1cns_c01 CHITINASE user 2 3 # 2 B 67 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B 89 GLU B 28 GLU~? 8.04 O1 BGOL B 114 B 120 SER B 30 SER~? 7.11 O3 AGOL B 114 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 8.17 18.37 77.00 9.28 16.58 76.89 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 7.99 29.80 81.55 8.79 31.72 80.96 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 1.68 25.09 82.95 3.64 23.84 82.25 1cns_c01 source 1cns CHITINASE : 2 hits 1cns_c01 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 75 TYR~? 14.24 CL CL A 114 A 173 ASP A 71 ASP~? 16.51 CL CL A 114 C 48 ARG A 84 ARG~? 10.06 CL CL A 114 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 21.81 10.09 65.59 20.00 9.75 63.52 coo 24.35 4.55 25.11 25.94 3.23 25.53 25.70 13.65 72.38 26.87 11.94 72.89 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 101 TYR A 75 TYR~? 14.24 CL CL A 114 A 173 ASP A 72 ASP~? 17.54 O2 AGOL B 114 C 48 ARG A 84 ARG~? 10.06 CL CL A 114 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 21.81 10.09 65.59 20.00 9.75 63.52 coo 24.35 4.55 25.11 25.94 3.23 25.53 26.30 14.43 67.36 25.07 16.12 67.01 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 C 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 24.35 4.55 25.11 25.94 3.23 25.53 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 C 48 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 24.35 4.55 25.11 25.94 3.23 25.53 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 173 ASP B 72 ASP~? 17.82 O3 GOL A 115 C 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 24.35 4.55 25.11 25.94 3.23 25.53 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -8.32 22.59 81.65 -10.97 23.53 80.37 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 84 ARG~? 10.06 CL CL A 114 C 101 TYR A 75 TYR~? 14.24 CL CL A 114 C 173 ASP A 71 ASP~? 16.51 CL CL A 114 coo 32.27 5.62 48.15 31.93 6.48 51.06 19.14 1.97 63.54 20.03 2.37 60.64 coo 29.64 3.64 57.39 31.22 5.14 55.65 21.81 10.09 65.59 20.00 9.75 63.52 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 25.70 13.65 72.38 26.87 11.94 72.89 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 48 ARG A 84 ARG~? 10.06 CL CL A 114 C 101 TYR A 75 TYR~? 14.24 CL CL A 114 C 173 ASP A 72 ASP~? 17.54 O2 AGOL B 114 coo 32.27 5.62 48.15 31.93 6.48 51.06 19.14 1.97 63.54 20.03 2.37 60.64 coo 29.64 3.64 57.39 31.22 5.14 55.65 21.81 10.09 65.59 20.00 9.75 63.52 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 26.30 14.43 67.36 25.07 16.12 67.01 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 C 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 C 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 32.27 5.62 48.15 31.93 6.48 51.06 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 29.64 3.64 57.39 31.22 5.14 55.65 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -5.76 9.33 88.77 -5.88 10.77 90.36 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 C 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 C 173 ASP B 72 ASP~? 17.82 O3 GOL A 115 coo 32.27 5.62 48.15 31.93 6.48 51.06 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 29.64 3.64 57.39 31.22 5.14 55.65 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -10.25 9.55 86.42 -10.16 8.13 84.85 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 48 ARG B 102 ARG^? 14.15 O2 GOL A 115 C 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 C 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 32.27 5.62 48.15 31.93 6.48 51.06 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 29.64 3.64 57.39 31.22 5.14 55.65 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -5.76 9.33 88.77 -5.88 10.77 90.36 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 84 ARG~? 10.06 CL CL A 114 D 101 TYR A 75 TYR~? 14.24 CL CL A 114 D 173 ASP A 72 ASP~? 17.54 O2 AGOL B 114 coo 69.08 8.58 32.60 69.70 10.81 30.58 19.14 1.97 63.54 20.03 2.37 60.64 coo 71.77 11.86 24.26 70.23 12.22 26.56 21.81 10.09 65.59 20.00 9.75 63.52 coo 71.60 6.14 19.25 70.26 6.87 20.69 26.30 14.43 67.36 25.07 16.12 67.01 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 48 ARG A 102 ARG^? 13.83 O2 AGOL B 114 D 101 TYR A 75 TYR~? 14.24 CL CL A 114 D 173 ASP A 71 ASP~? 16.51 CL CL A 114 coo 69.08 8.58 32.60 69.70 10.81 30.58 16.77 16.26 64.57 17.43 19.14 63.66 coo 71.77 11.86 24.26 70.23 12.22 26.56 21.81 10.09 65.59 20.00 9.75 63.52 coo 71.60 6.14 19.25 70.26 6.87 20.69 25.70 13.65 72.38 26.87 11.94 72.89 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 D 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 D 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 69.08 8.58 32.60 69.70 10.81 30.58 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 71.77 11.86 24.26 70.23 12.22 26.56 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 71.60 6.14 19.25 70.26 6.87 20.69 -5.76 9.33 88.77 -5.88 10.77 90.36 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 D 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 D 173 ASP B 72 ASP~? 17.82 O3 GOL A 115 coo 69.08 8.58 32.60 69.70 10.81 30.58 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 71.77 11.86 24.26 70.23 12.22 26.56 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 71.60 6.14 19.25 70.26 6.87 20.69 -10.25 9.55 86.42 -10.16 8.13 84.85 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 48 ARG B 102 ARG^? 14.15 O2 GOL A 115 D 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 D 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 69.08 8.58 32.60 69.70 10.81 30.58 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 71.77 11.86 24.26 70.23 12.22 26.56 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 71.60 6.14 19.25 70.26 6.87 20.69 -5.76 9.33 88.77 -5.88 10.77 90.36 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 75 TYR~? 14.24 CL CL A 114 B 173 ASP A 71 ASP~? 16.51 CL CL A 114 D 48 ARG A 84 ARG~? 10.06 CL CL A 114 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 21.81 10.09 65.59 20.00 9.75 63.52 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 25.70 13.65 72.38 26.87 11.94 72.89 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 101 TYR A 75 TYR~? 14.24 CL CL A 114 B 173 ASP A 72 ASP~? 17.54 O2 AGOL B 114 D 48 ARG A 84 ARG~? 10.06 CL CL A 114 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 21.81 10.09 65.59 20.00 9.75 63.52 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 26.30 14.43 67.36 25.07 16.12 67.01 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 D 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 173 ASP B 71 ASP~? 19.48 O2 GOL A 115 D 48 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 101 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 173 ASP B 72 ASP~? 17.82 O3 GOL A 115 D 48 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -8.32 22.59 81.65 -10.97 23.53 80.37 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1cs1_c03 naa= 3 ULMN 3 1d7r_c01 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 138 TRP A 87 TRP~? 11.00 O1 GOL A 115 A 243 ASP A 32 ASP.? 10.78 CL CL A 114 A 272 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 18.21 54.75 18.05 19.91 55.17 21.59 14.09 -2.53 67.71 14.42 1.36 68.01 coo 16.93 55.67 9.65 17.16 54.23 11.19 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 14.13 45.79 13.40 14.25 49.41 18.30 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1d7r_c01 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 2 3 # 2 A 138 TRP B 87 TRP~? 10.98 O3 AGOL B 114 A 243 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 272 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 18.21 54.75 18.05 19.91 55.17 21.59 -1.46 27.41 80.24 -1.42 23.56 79.72 coo 16.93 55.67 9.65 17.16 54.23 11.19 0.49 28.13 88.01 2.42 28.83 88.55 coo 14.13 45.79 13.40 14.25 49.41 18.30 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 A 243 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 272 LYS B 10 LYS.? 17.18 O2 BGOL B 114 coo 2.03 68.31 21.46 0.66 68.36 23.90 21.81 10.09 65.59 20.00 9.75 63.52 coo 16.93 55.67 9.65 17.16 54.23 11.19 9.86 30.83 63.58 9.25 29.72 61.91 coo 14.13 45.79 13.40 14.25 49.41 18.30 1.10 28.15 64.50 5.88 30.75 61.34 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 2 3 # 2 A 173 TYR A 75 TYR~? 14.24 CL CL A 114 A 243 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 272 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 2.03 68.31 21.46 0.66 68.36 23.90 21.81 10.09 65.59 20.00 9.75 63.52 coo 16.93 55.67 9.65 17.16 54.23 11.19 4.69 24.83 64.29 4.38 25.55 62.31 coo 14.13 45.79 13.40 14.25 49.41 18.30 -4.67 17.57 66.69 -7.33 13.35 64.02 1d7r_c02 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 2 hits 1d7r_c02 naa= 3 ULMN 3 1ddj_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 60 HIS.? 17.72 O2 GOL A 115 A 646 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 739 GLY A 13 GLY.? 22.56 O2 GOL A 115 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 11.37 50.89 2.29 11.05 51.63 2.25 -3.15 -7.64 57.16 -3.10 -7.17 57.77 1ddj_c12 source 1ddj PLASMINOGEN : 1 hits 1ddj_c12 naa= 3 ULMN 3 1ddj_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 646 ASP A 32 ASP.? 10.78 CL CL A 114 B 739 GLY A 91 GLY~? 13.45 O1 GOL A 115 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 15.30 -2.41 76.92 13.57 -1.61 77.79 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 9.66 -1.47 63.03 9.76 -1.88 62.33 ULMN 3 1ddj_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS A 60 HIS.? 17.72 O2 GOL A 115 B 646 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 739 GLY A 13 GLY.? 22.56 O2 GOL A 115 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 -6.29 5.83 61.74 -6.55 4.46 63.31 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 -3.15 -7.64 57.16 -3.10 -7.17 57.77 1ddj_c13 source 1ddj PLASMINOGEN : 2 hits 1ddj_c13 naa= 3 ULMN 3 1ddj_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 31 HIS~? 8.53 C1 GOL A 115 C 646 ASP A 32 ASP.? 10.78 CL CL A 114 C 739 GLY A 91 GLY~? 13.45 O1 GOL A 115 coo 15.33 59.81 59.60 13.98 60.99 60.69 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 16.06 55.72 54.73 15.97 56.49 56.70 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 9.38 49.29 65.28 9.01 50.03 65.31 9.66 -1.47 63.03 9.76 -1.88 62.33 ULMN 3 1ddj_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 60 HIS.? 17.72 O2 GOL A 115 C 646 ASP A 62 ASP.? 15.17 O2 GOL A 115 C 739 GLY A 13 GLY.? 22.56 O2 GOL A 115 coo 15.33 59.81 59.60 13.98 60.99 60.69 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 16.06 55.72 54.73 15.97 56.49 56.70 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 9.38 49.29 65.28 9.01 50.03 65.31 -3.15 -7.64 57.16 -3.10 -7.17 57.77 1ddj_c14 source 1ddj PLASMINOGEN : 2 hits 1ddj_c14 naa= 3 ULMN 3 1ddj_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 31 HIS~? 8.53 C1 GOL A 115 D 646 ASP A 32 ASP.? 10.78 CL CL A 114 D 739 GLY A 91 GLY~? 13.45 O1 GOL A 115 coo -30.51 33.83 43.05 -30.50 33.12 45.03 15.30 -2.41 76.92 13.57 -1.61 77.79 coo -25.73 33.05 39.28 -27.50 34.05 39.88 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -27.66 47.32 40.66 -27.81 47.01 41.41 9.66 -1.47 63.03 9.76 -1.88 62.33 ULMN 3 1ddj_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 60 HIS.? 17.72 O2 GOL A 115 D 646 ASP A 62 ASP.? 15.17 O2 GOL A 115 D 739 GLY A 13 GLY.? 22.56 O2 GOL A 115 coo -30.51 33.83 43.05 -30.50 33.12 45.03 -6.29 5.83 61.74 -6.55 4.46 63.31 coo -25.73 33.05 39.28 -27.50 34.05 39.88 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -27.66 47.32 40.66 -27.81 47.01 41.41 -3.15 -7.64 57.16 -3.10 -7.17 57.77 ULMN 3 1ddj_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS B 31 HIS~? 8.39 O3 AGOL B 114 D 646 ASP B 32 ASP.? 14.27 O1 BGOL B 114 D 739 GLY B 91 GLY~? 14.09 O3 AGOL B 114 coo -30.51 33.83 43.05 -30.50 33.12 45.03 5.80 25.06 85.89 7.38 24.42 84.67 coo -25.73 33.05 39.28 -27.50 34.05 39.88 0.49 28.13 88.01 2.42 28.83 88.55 coo -27.66 47.32 40.66 -27.81 47.01 41.41 -3.22 28.60 73.91 -3.61 29.33 73.83 1ddj_c15 source 1ddj PLASMINOGEN : 3 hits 1ddj_c15 naa= 3 ULMN 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 1 3 # 1 A 50 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 96 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 137 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 1.83 2.95 4.76 1.26 0.98 4.81 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 2.09 -1.43 1.72 1.90 -3.41 2.37 9.84 -6.23 75.42 9.01 -8.17 75.63 coo -3.67 -7.38 4.26 -2.89 -5.51 4.56 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 2 3 # 2 A 50 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 96 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 137 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 1.83 2.95 4.76 1.26 0.98 4.81 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 2.09 -1.43 1.72 1.90 -3.41 2.37 9.84 -6.23 75.42 9.01 -8.17 75.63 coo -3.67 -7.38 4.26 -2.89 -5.51 4.56 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 3 3 # 3 A 50 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 96 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 137 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 1.83 2.95 4.76 1.26 0.98 4.81 5.80 25.06 85.89 7.38 24.42 84.67 coo 2.09 -1.43 1.72 1.90 -3.41 2.37 7.99 29.80 81.55 8.79 31.72 80.96 coo -3.67 -7.38 4.26 -2.89 -5.51 4.56 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 4 3 # 4 A 50 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 96 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 137 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 1.83 2.95 4.76 1.26 0.98 4.81 5.80 25.06 85.89 7.38 24.42 84.67 coo 2.09 -1.43 1.72 1.90 -3.41 2.37 7.99 29.80 81.55 8.79 31.72 80.96 coo -3.67 -7.38 4.26 -2.89 -5.51 4.56 -1.03 31.78 76.72 0.89 32.00 75.91 1de3_c00 source 1de3 RIBONUCLEASE ALPHA-SARCIN : 4 hits 1de3_c00 naa= 3 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 # 1 B 141 GLY A 65 GLY^? 7.74 O1 GOL A 115 B 144 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 164 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 88.87 114.43 152.30 88.45 115.15 152.32 7.16 5.92 68.88 6.95 6.74 68.72 coo 85.20 111.99 152.05 86.60 110.89 150.91 10.15 10.32 71.63 9.22 11.91 72.68 coo 88.14 113.46 145.73 86.79 113.92 147.30 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 2 3 # 2 B 141 GLY B 65 GLY^? 7.90 O3 AGOL B 114 B 144 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 164 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 88.87 114.43 152.30 88.45 115.15 152.32 2.73 19.42 73.25 2.63 18.67 72.86 coo 85.20 111.99 152.05 86.60 110.89 150.91 2.66 14.38 76.39 3.95 12.75 76.00 coo 88.14 113.46 145.73 86.79 113.92 147.30 8.17 18.37 77.00 9.28 16.58 76.89 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 65 GLY^? 7.74 O1 GOL A 115 C 144 GLU A 66 GLU^? 10.35 O1 GOL A 115 C 164 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 56.28 104.55 135.84 56.09 105.34 136.05 7.16 5.92 68.88 6.95 6.74 68.72 coo 58.46 103.90 139.48 57.57 102.00 139.16 10.15 10.32 71.63 9.22 11.91 72.68 coo 51.71 102.03 140.09 53.02 103.62 140.54 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 # 2 C 141 GLY B 65 GLY^? 7.90 O3 AGOL B 114 C 144 GLU B 66 GLU^? 10.26 O3 BGOL B 114 C 164 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 56.28 104.55 135.84 56.09 105.34 136.05 2.73 19.42 73.25 2.63 18.67 72.86 coo 58.46 103.90 139.48 57.57 102.00 139.16 2.66 14.38 76.39 3.95 12.75 76.00 coo 51.71 102.03 140.09 53.02 103.62 140.54 8.17 18.37 77.00 9.28 16.58 76.89 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 65 GLY^? 7.74 O1 GOL A 115 D 144 GLU A 66 GLU^? 10.35 O1 GOL A 115 D 164 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 86.19 80.64 132.77 86.38 79.85 132.93 7.16 5.92 68.88 6.95 6.74 68.72 coo 84.75 81.24 136.88 85.62 83.14 136.43 10.15 10.32 71.63 9.22 11.91 72.68 coo 91.47 83.05 136.24 90.35 81.38 136.84 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 # 2 D 141 GLY B 65 GLY^? 7.90 O3 AGOL B 114 D 144 GLU B 66 GLU^? 10.26 O3 BGOL B 114 D 164 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 86.19 80.64 132.77 86.38 79.85 132.93 2.73 19.42 73.25 2.63 18.67 72.86 coo 84.75 81.24 136.88 85.62 83.14 136.43 2.66 14.38 76.39 3.95 12.75 76.00 coo 91.47 83.05 136.24 90.35 81.38 136.84 8.17 18.37 77.00 9.28 16.58 76.89 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 65 GLY^? 7.74 O1 GOL A 115 E 144 GLU A 66 GLU^? 10.35 O1 GOL A 115 E 164 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 90.07 81.07 170.50 90.23 80.26 170.38 7.16 5.92 68.88 6.95 6.74 68.72 coo 87.05 81.30 167.53 86.38 82.74 168.94 10.15 10.32 71.63 9.22 11.91 72.68 coo 84.40 80.02 173.80 85.08 79.06 172.03 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1dub_c16 2-ENOYL-COA HYDRATASE user 2 3 # 2 E 141 GLY B 65 GLY^? 7.90 O3 AGOL B 114 E 144 GLU B 66 GLU^? 10.26 O3 BGOL B 114 E 164 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 90.07 81.07 170.50 90.23 80.26 170.38 2.73 19.42 73.25 2.63 18.67 72.86 coo 87.05 81.30 167.53 86.38 82.74 168.94 2.66 14.38 76.39 3.95 12.75 76.00 coo 84.40 80.02 173.80 85.08 79.06 172.03 8.17 18.37 77.00 9.28 16.58 76.89 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 65 GLY^? 7.74 O1 GOL A 115 F 144 GLU A 66 GLU^? 10.35 O1 GOL A 115 F 164 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 57.12 70.68 155.10 57.52 69.95 155.02 7.16 5.92 68.88 6.95 6.74 68.72 coo 60.62 73.13 154.21 59.05 74.26 153.35 10.15 10.32 71.63 9.22 11.91 72.68 coo 56.75 71.71 148.46 58.44 71.01 149.54 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 # 2 F 141 GLY B 65 GLY^? 7.90 O3 AGOL B 114 F 144 GLU B 66 GLU^? 10.26 O3 BGOL B 114 F 164 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 57.12 70.68 155.10 57.52 69.95 155.02 2.73 19.42 73.25 2.63 18.67 72.86 coo 60.62 73.13 154.21 59.05 74.26 153.35 2.66 14.38 76.39 3.95 12.75 76.00 coo 56.75 71.71 148.46 58.44 71.01 149.54 8.17 18.37 77.00 9.28 16.58 76.89 1dub_c17 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c17 naa= 3 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 A 131 LYS B 99 LYS^? 20.46 O2 GOL A 115 A 215 LYS B 92 LYS~? 22.65 O3 AGOL B 114 A 277 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 0.50 24.09 51.68 1.51 29.34 52.35 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 13.06 30.79 51.73 11.40 35.76 53.48 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 13.04 31.88 60.72 10.57 35.34 57.49 -9.57 27.75 81.15 -15.18 26.42 83.82 1e19_c00 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 1 hits 1e19_c00 naa= 3 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 B 131 LYS B 99 LYS^? 20.46 O2 GOL A 115 B 215 LYS B 92 LYS~? 22.65 O3 AGOL B 114 B 277 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 6.78 45.91 16.15 7.82 40.81 15.84 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 17.88 38.77 19.81 16.38 34.23 17.24 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 20.33 37.78 11.20 16.77 34.53 13.47 -9.57 27.75 81.15 -15.18 26.42 83.82 1e19_c01 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 1 hits 1e19_c01 naa= 3 ULMN 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 1 3 # 1 B 41 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 43 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 65 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo 20.15 22.08 34.36 20.84 20.10 34.21 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 19.55 18.91 30.27 18.21 18.65 31.84 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 10.90 21.31 28.81 12.14 22.15 30.31 9.84 -6.23 75.42 9.01 -8.17 75.63 ULMN 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 2 3 # 2 B 41 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 43 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 65 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo 20.15 22.08 34.36 20.84 20.10 34.21 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 19.55 18.91 30.27 18.21 18.65 31.84 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 10.90 21.31 28.81 12.14 22.15 30.31 9.84 -6.23 75.42 9.01 -8.17 75.63 ULMN 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 3 3 # 3 B 41 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 43 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 65 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 20.15 22.08 34.36 20.84 20.10 34.21 0.85 27.13 76.55 -1.16 26.55 76.75 coo 19.55 18.91 30.27 18.21 18.65 31.84 -1.03 31.78 76.72 0.89 32.00 75.91 coo 10.90 21.31 28.81 12.14 22.15 30.31 7.99 29.80 81.55 8.79 31.72 80.96 ULMN 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 4 3 # 4 B 41 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 43 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 65 GLU B 89 GLU~? 21.63 O3 AGOL B 114 coo 20.15 22.08 34.36 20.84 20.10 34.21 0.85 27.13 76.55 -1.16 26.55 76.75 coo 19.55 18.91 30.27 18.21 18.65 31.84 -1.03 31.78 76.72 0.89 32.00 75.91 coo 10.90 21.31 28.81 12.14 22.15 30.31 -9.38 32.01 77.42 -10.46 31.89 75.58 ULMN 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 5 3 # 5 B 41 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 43 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 65 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 20.15 22.08 34.36 20.84 20.10 34.21 -1.03 31.78 76.72 0.89 32.00 75.91 coo 19.55 18.91 30.27 18.21 18.65 31.84 0.85 27.13 76.55 -1.16 26.55 76.75 coo 10.90 21.31 28.81 12.14 22.15 30.31 7.99 29.80 81.55 8.79 31.72 80.96 1e7l_c01 source 1e7l RECOMBINATION ENDONUCLEASE VII : 5 hits 1e7l_c01 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 A 35 SER A 15 SER~? 16.97 O3 GOL A 115 A 218 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 47.22 22.34 8.57 45.16 22.02 9.13 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 43.58 20.85 5.15 44.62 23.01 5.76 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 44.05 16.99 12.67 44.05 18.89 11.74 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 2 3 # 2 A 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 35 SER B 15 SER~? 17.11 O1 AGOL B 114 A 218 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 47.22 22.34 8.57 45.16 22.02 9.13 9.86 30.83 63.58 9.25 29.72 61.91 coo 43.58 20.85 5.15 44.62 23.01 5.76 6.70 34.48 63.20 7.42 36.00 64.96 coo 44.05 16.99 12.67 44.05 18.89 11.74 4.69 24.83 64.29 4.38 25.55 62.31 1eag_c04 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c04 naa= 3 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 1 3 # 1 A 99 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 177 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 203 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 8.74 45.76 47.19 9.33 46.93 45.56 4.96 22.92 58.66 6.72 23.67 59.53 coo 11.68 42.31 52.96 12.05 43.92 51.65 4.69 24.83 64.29 4.38 25.55 62.31 coo 18.07 52.81 49.62 14.17 49.99 48.07 -4.67 17.57 66.69 -7.33 13.35 64.02 1ecx_c02 source 1ecx AMINOTRANSFERASE : 1 hits 1ecx_c02 naa= 3 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 1 3 # 1 B 99 HIS B 60 HIS.? 17.24 O2 AGOL B 114 B 177 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 203 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 14.87 88.04 21.51 13.64 87.90 19.81 4.96 22.92 58.66 6.72 23.67 59.53 coo 15.87 92.46 27.37 14.46 91.76 25.94 4.69 24.83 64.29 4.38 25.55 62.31 coo 3.60 91.42 23.52 8.20 89.55 22.63 -4.67 17.57 66.69 -7.33 13.35 64.02 1ecx_c03 source 1ecx AMINOTRANSFERASE : 1 hits 1ecx_c03 naa= 3 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 3 # 1 P 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 P 35 SER A 15 SER~? 16.97 O3 GOL A 115 P 215 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 10.15 33.41 11.98 7.98 33.66 12.07 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 7.57 37.60 10.00 8.86 37.02 12.03 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 4.04 29.97 8.82 4.78 31.15 10.46 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 2 3 # 2 P 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 P 35 SER B 15 SER~? 17.11 O1 AGOL B 114 P 215 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 10.15 33.41 11.98 7.98 33.66 12.07 9.86 30.83 63.58 9.25 29.72 61.91 coo 7.57 37.60 10.00 8.86 37.02 12.03 6.70 34.48 63.20 7.42 36.00 64.96 coo 4.04 29.97 8.82 4.78 31.15 10.46 4.69 24.83 64.29 4.38 25.55 62.31 1eed_c04 source 1eed ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLEX WITH TH: 2 hits 1eed_c04 naa= 3 ULMN 3 1ef8_c00 METHYLMALONYL COA DECARBOXYLASE user 1 3 # 1 A 66 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 110 GLY A 91 GLY~? 13.45 O1 GOL A 115 A 140 TYR A 6 TYR^? 13.03 O1 GOL A 115 coo 24.53 0.12 1.91 23.47 1.90 2.27 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 22.96 1.26 5.85 23.32 1.32 6.60 9.66 -1.47 63.03 9.76 -1.88 62.33 coo 21.28 7.32 1.28 21.07 5.14 3.02 9.35 7.19 64.40 12.10 6.95 63.91 1ef8_c00 source 1ef8 METHYLMALONYL COA DECARBOXYLASE : 1 hits 1ef8_c00 naa= 3 ULMN 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 1 3 # 1 B 66 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 110 GLY A 91 GLY~? 13.45 O1 GOL A 115 B 140 TYR A 6 TYR^? 13.03 O1 GOL A 115 coo 15.25 42.02 9.50 15.08 40.17 8.54 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 16.54 37.86 10.86 17.07 37.78 11.48 9.66 -1.47 63.03 9.76 -1.88 62.33 coo 8.70 35.97 10.91 11.44 36.02 10.35 9.35 7.19 64.40 12.10 6.95 63.91 1ef8_c01 source 1ef8 METHYLMALONYL COA DECARBOXYLASE : 1 hits 1ef8_c01 naa= 3 ULMN 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 1 3 # 1 C 66 HIS A 26 HIS~? 10.00 O1 GOL A 115 C 110 GLY A 91 GLY~? 13.45 O1 GOL A 115 C 140 TYR A 6 TYR^? 13.03 O1 GOL A 115 coo -9.82 10.01 28.41 -9.17 11.02 26.71 9.87 -1.78 67.67 11.19 -0.83 66.35 coo -5.73 12.49 27.77 -5.15 12.61 28.37 9.66 -1.47 63.03 9.76 -1.88 62.33 coo -4.68 8.05 21.05 -4.91 10.19 22.84 9.35 7.19 64.40 12.10 6.95 63.91 1ef8_c02 source 1ef8 METHYLMALONYL COA DECARBOXYLASE : 1 hits 1ef8_c02 naa= 3 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 B 107 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 246 ASP A 57 ASP.? 26.60 O2 GOL A 115 B 275 HIS A 60 HIS.? 17.72 O2 GOL A 115 coo 34.84 56.77 81.62 34.95 54.74 82.03 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 43.18 49.30 68.39 44.75 49.87 69.78 -7.42 17.52 58.35 -7.76 15.77 57.13 coo 38.73 55.10 77.62 36.80 55.01 78.46 -6.29 5.83 61.74 -6.55 4.46 63.31 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 B 107 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 246 ASP A 57 ASP.? 26.60 O2 GOL A 115 B 275 HIS B 60 HIS.? 17.24 O2 AGOL B 114 coo 34.84 56.77 81.62 34.95 54.74 82.03 4.69 24.83 64.29 4.38 25.55 62.31 coo 43.18 49.30 68.39 44.75 49.87 69.78 -7.42 17.52 58.35 -7.76 15.77 57.13 coo 38.73 55.10 77.62 36.80 55.01 78.46 4.96 22.92 58.66 6.72 23.67 59.53 1ehy_c01 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 2 hits 1ehy_c01 naa= 3 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 C 107 ASP A 62 ASP.? 15.17 O2 GOL A 115 C 246 ASP A 57 ASP.? 26.60 O2 GOL A 115 C 275 HIS A 60 HIS.? 17.72 O2 GOL A 115 coo 1.90 35.26 72.76 3.20 35.74 71.18 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 12.03 20.33 71.56 10.48 19.25 70.56 -7.42 17.52 58.35 -7.76 15.77 57.13 coo 3.92 29.96 71.75 4.22 31.96 72.31 -6.29 5.83 61.74 -6.55 4.46 63.31 1ehy_c02 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 1 hits 1ehy_c02 naa= 3 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 D 107 ASP A 62 ASP.? 15.17 O2 GOL A 115 D 246 ASP A 57 ASP.? 26.60 O2 GOL A 115 D 275 HIS A 60 HIS.? 17.72 O2 GOL A 115 coo 37.41 19.89 81.58 37.64 21.98 81.53 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 23.50 26.43 88.52 24.76 26.47 90.29 -7.42 17.52 58.35 -7.76 15.77 57.13 coo 33.16 21.44 85.29 34.07 21.53 83.40 -6.29 5.83 61.74 -6.55 4.46 63.31 1ehy_c03 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 1 hits 1ehy_c03 naa= 3 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 A 114 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 197 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 223 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 4.96 22.92 58.66 6.72 23.67 59.53 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 4.69 24.83 64.29 4.38 25.55 62.31 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 -4.67 17.57 66.69 -7.33 13.35 64.02 1elq_c02 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 1 hits 1elq_c02 naa= 3 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 B 114 HIS B 60 HIS.? 17.24 O2 AGOL B 114 B 197 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 223 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 4.96 22.92 58.66 6.72 23.67 59.53 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 4.69 24.83 64.29 4.38 25.55 62.31 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 -4.67 17.57 66.69 -7.33 13.35 64.02 1elq_c03 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 1 hits 1elq_c03 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 104 ALA^? 7.60 O2 AGOL B 114 A 257 ALA B 45 ALA^? 11.50 O2 AGOL B 114 A 328 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 39.84 24.12 8.44 38.50 24.23 9.11 13.87 20.71 69.74 14.50 21.78 68.82 coo 43.22 26.73 5.37 41.81 27.09 5.79 12.95 21.14 63.86 14.23 20.76 64.58 coo 38.17 34.10 6.67 37.72 32.06 6.84 4.69 24.83 64.29 4.38 25.55 62.31 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA B 104 ALA^? 7.64 O2 GOL A 115 A 257 ALA A 45 ALA^? 11.44 O2 GOL A 115 A 328 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 39.84 24.12 8.44 38.50 24.23 9.11 -2.07 4.32 76.12 -3.28 3.38 75.81 coo 43.22 26.73 5.37 41.81 27.09 5.79 -6.43 5.27 72.35 -6.42 5.31 73.89 coo 38.17 34.10 6.67 37.72 32.06 6.84 -2.26 2.59 64.84 -3.73 2.30 63.39 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 2 hits 1eo7_c00 naa= 3 ULMN 3 1eq2_c00 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 A 116 SER A 81 SER~? -3.02 CL CL A 114s A 140 TYR A 78 TYR~? 10.44 CL CL A 114 A 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo 34.67 35.79 48.83 33.57 37.88 49.47 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 29.60 38.99 53.89 30.10 37.88 51.36 20.68 4.89 66.65 17.95 4.78 66.23 coo 32.73 32.94 54.42 29.29 32.83 50.35 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c00 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 A 116 SER B 81 SER~? 19.76 O3 AGOL B 114 A 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 A 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 34.67 35.79 48.83 33.57 37.88 49.47 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 29.60 38.99 53.89 30.10 37.88 51.36 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 32.73 32.94 54.42 29.29 32.83 50.35 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c00 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c00 naa= 3 ULMN 3 1eq2_c01 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 B 116 SER A 81 SER~? -3.02 CL CL A 114s B 140 TYR A 78 TYR~? 10.44 CL CL A 114 B 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo 30.90 35.65 89.60 29.85 37.72 88.83 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 24.43 38.83 86.53 27.07 38.03 86.12 20.68 4.89 66.65 17.95 4.78 66.23 coo 25.13 32.62 89.49 27.74 32.61 84.91 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c01 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 B 116 SER B 81 SER~? 19.76 O3 AGOL B 114 B 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 B 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 30.90 35.65 89.60 29.85 37.72 88.83 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 24.43 38.83 86.53 27.07 38.03 86.12 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 25.13 32.62 89.49 27.74 32.61 84.91 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c01 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c01 naa= 3 ULMN 3 1eq2_c02 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 C 116 SER A 81 SER~? -3.02 CL CL A 114s C 140 TYR A 78 TYR~? 10.44 CL CL A 114 C 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo -8.96 33.70 98.81 -8.96 35.77 97.56 24.92 -0.43 64.22 23.66 -1.27 66.14 coo -8.28 37.01 91.79 -6.99 36.16 94.13 20.68 4.89 66.65 17.95 4.78 66.23 coo -10.48 30.66 93.19 -5.27 31.07 94.32 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c02 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 C 116 SER B 81 SER~? 19.76 O3 AGOL B 114 C 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 C 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -8.96 33.70 98.81 -8.96 35.77 97.56 -10.56 24.73 86.75 -8.28 25.51 87.05 coo -8.28 37.01 91.79 -6.99 36.16 94.13 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -10.48 30.66 93.19 -5.27 31.07 94.32 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c02 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c02 naa= 3 ULMN 3 1eq2_c03 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 D 116 SER A 81 SER~? -3.02 CL CL A 114s D 140 TYR A 78 TYR~? 10.44 CL CL A 114 D 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo -29.80 31.30 63.54 -28.79 33.52 63.37 24.92 -0.43 64.22 23.66 -1.27 66.14 coo -23.30 35.33 62.20 -25.10 34.24 64.06 20.68 4.89 66.65 17.95 4.78 66.23 coo -24.76 28.82 60.31 -24.27 29.01 65.58 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c03 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 D 116 SER B 81 SER~? 19.76 O3 AGOL B 114 D 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 D 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -29.80 31.30 63.54 -28.79 33.52 63.37 -10.56 24.73 86.75 -8.28 25.51 87.05 coo -23.30 35.33 62.20 -25.10 34.24 64.06 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -24.76 28.82 60.31 -24.27 29.01 65.58 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c03 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c03 naa= 3 ULMN 3 1eq2_c04 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 E 116 SER A 81 SER~? -3.02 CL CL A 114s E 140 TYR A 78 TYR~? 10.44 CL CL A 114 E 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo -3.01 32.72 32.71 -2.80 34.91 33.79 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 0.04 36.70 38.68 -2.21 35.46 37.50 20.68 4.89 66.65 17.95 4.78 66.23 coo 1.93 30.52 36.31 -2.84 30.18 38.54 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c04 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 E 116 SER B 81 SER~? 19.76 O3 AGOL B 114 E 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 E 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -3.01 32.72 32.71 -2.80 34.91 33.79 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 0.04 36.70 38.68 -2.21 35.46 37.50 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 1.93 30.52 36.31 -2.84 30.18 38.54 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c04 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c04 naa= 3 ULMN 3 1eq2_c05 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 F 116 SER A 81 SER~? -3.02 CL CL A 114s F 140 TYR A 78 TYR~? 10.44 CL CL A 114 F 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo 55.30 92.46 56.72 55.15 90.39 55.38 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 54.49 89.31 49.65 53.35 90.16 52.06 20.68 4.89 66.65 17.95 4.78 66.23 coo 56.78 95.62 51.15 51.59 95.31 52.37 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c05 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 F 116 SER B 81 SER~? 19.76 O3 AGOL B 114 F 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 F 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 55.30 92.46 56.72 55.15 90.39 55.38 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 54.49 89.31 49.65 53.35 90.16 52.06 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 56.78 95.62 51.15 51.59 95.31 52.37 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c05 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c05 naa= 3 ULMN 3 1eq2_c06 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 G 116 SER A 81 SER~? -3.02 CL CL A 114s G 140 TYR A 78 TYR~? 10.44 CL CL A 114 G 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo 76.25 95.63 21.56 75.29 93.40 21.36 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 69.78 91.62 20.06 71.51 92.68 22.02 20.68 4.89 66.65 17.95 4.78 66.23 coo 71.19 98.21 18.32 70.69 97.75 23.67 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c06 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 G 116 SER B 30 SER~? 7.11 O3 AGOL B 114 G 140 TYR B 27 TYR~? -3.70 O3 AGOL B 114s G 144 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 76.25 95.63 21.56 75.29 93.40 21.36 1.68 25.09 82.95 3.64 23.84 82.25 coo 69.78 91.62 20.06 71.51 92.68 22.02 7.36 24.77 79.77 8.81 23.32 81.62 coo 71.19 98.21 18.32 70.69 97.75 23.67 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1eq2_c06 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 3 3 # 3 G 116 SER B 81 SER~? 19.76 O3 AGOL B 114 G 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 G 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 76.25 95.63 21.56 75.29 93.40 21.36 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 69.78 91.62 20.06 71.51 92.68 22.02 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 71.19 98.21 18.32 70.69 97.75 23.67 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c06 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 3 hits 1eq2_c06 naa= 3 ULMN 3 1eq2_c07 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 H 116 SER A 81 SER~? -3.02 CL CL A 114s H 140 TYR A 78 TYR~? 10.44 CL CL A 114 H 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo 15.45 90.62 47.70 16.55 88.57 46.97 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 21.92 87.58 44.67 19.30 88.41 44.23 20.68 4.89 66.65 17.95 4.78 66.23 coo 21.26 93.70 47.67 18.47 93.68 43.08 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c07 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 H 116 SER B 81 SER~? 19.76 O3 AGOL B 114 H 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 H 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 15.45 90.62 47.70 16.55 88.57 46.97 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 21.92 87.58 44.67 19.30 88.41 44.23 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 21.26 93.70 47.67 18.47 93.68 43.08 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c07 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c07 naa= 3 ULMN 3 1eq2_c08 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 I 116 SER A 81 SER~? -3.02 CL CL A 114s I 140 TYR A 78 TYR~? 10.44 CL CL A 114 I 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo 11.78 90.82 7.18 12.84 88.72 7.93 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 16.78 87.76 12.19 16.39 88.69 9.59 20.68 4.89 66.65 17.95 4.78 66.23 coo 13.67 93.83 12.65 17.08 93.94 8.58 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c08 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 I 116 SER B 81 SER~? 19.76 O3 AGOL B 114 I 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 I 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 11.78 90.82 7.18 12.84 88.72 7.93 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 16.78 87.76 12.19 16.39 88.69 9.59 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 13.67 93.83 12.65 17.08 93.94 8.58 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c08 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c08 naa= 3 ULMN 3 1eq2_c09 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 J 116 SER A 81 SER~? -3.02 CL CL A 114s J 140 TYR A 78 TYR~? 10.44 CL CL A 114 J 144 LYS A 85 LYS~? 9.11 CL CL A 114 coo 49.46 93.97 -9.19 49.31 91.82 -8.04 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 46.51 90.06 -3.08 48.69 91.36 -4.30 20.68 4.89 66.65 17.95 4.78 66.23 coo 44.49 96.17 -5.53 49.37 96.61 -3.37 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1eq2_c09 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 J 116 SER B 81 SER~? 19.76 O3 AGOL B 114 J 140 TYR B 78 TYR~? 15.72 O3 AGOL B 114 J 144 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 49.46 93.97 -9.19 49.31 91.82 -8.04 -10.56 24.73 86.75 -8.28 25.51 87.05 coo 46.51 90.06 -3.08 48.69 91.36 -4.30 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 44.49 96.17 -5.53 49.37 96.61 -3.37 -9.57 27.75 81.15 -15.18 26.42 83.82 1eq2_c09 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c09 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP B 32 ASP.? 14.27 O1 BGOL B 114 260 GLU B 28 GLU~? 8.04 O1 BGOL B 114 370 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 8.60 -17.93 28.38 7.67 -19.04 26.88 0.49 28.13 88.01 2.42 28.83 88.55 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 7.99 29.80 81.55 8.79 31.72 80.96 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 7.36 24.77 79.77 8.81 23.32 81.62 1euu_c00 source 1euu SIALIDASE : 1 hits 1euu_c00 naa= 3 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 1 3 # 1 A 34 GLU B 46 GLU^? 18.15 O2 AGOL B 114 A 260 ARG A 84 ARG~? 10.06 CL CL A 114 A 270 LYS A 99 LYS.? 18.44 CL CL A 114 coo 50.99 29.43 12.86 52.11 29.45 14.65 14.18 17.59 59.29 15.88 16.34 59.02 coo 39.80 27.50 22.98 42.20 26.56 21.34 19.14 1.97 63.54 20.03 2.37 60.64 coo 48.83 21.70 19.50 47.44 24.99 15.25 10.32 8.81 58.96 14.77 8.28 57.43 1euy_c00 source 1euy GLUTAMINYL-TRNA SYNTHETASE : 1 hits 1euy_c00 naa= 3 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 1 3 # 1 A 156 LYS A 92 LYS~? 15.91 CL CL A 114 A 159 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 162 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 9.32 -0.83 59.34 13.60 2.28 58.11 coo 29.80 39.37 7.24 28.18 38.06 7.48 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 30.26 35.04 5.34 28.61 35.92 4.39 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 2 3 # 2 A 156 LYS A 92 LYS~? 15.91 CL CL A 114 A 159 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 162 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 9.32 -0.83 59.34 13.60 2.28 58.11 coo 29.80 39.37 7.24 28.18 38.06 7.48 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 30.26 35.04 5.34 28.61 35.92 4.39 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 3 3 # 3 A 156 LYS B 92 LYS~? 22.65 O3 AGOL B 114 A 159 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 162 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 29.80 39.37 7.24 28.18 38.06 7.48 0.85 27.13 76.55 -1.16 26.55 76.75 coo 30.26 35.04 5.34 28.61 35.92 4.39 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 4 3 # 4 A 156 LYS B 92 LYS~? 22.65 O3 AGOL B 114 A 159 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 162 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 29.80 39.37 7.24 28.18 38.06 7.48 -1.03 31.78 76.72 0.89 32.00 75.91 coo 30.26 35.04 5.34 28.61 35.92 4.39 0.85 27.13 76.55 -1.16 26.55 76.75 1f7u_c00 source 1f7u ARGINYL-TRNA SYNTHETASE : 4 hits 1f7u_c00 naa= 3 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 1 3 # 1 A 105 HIS A 60 HIS.? 17.72 O2 GOL A 115 C 62 LYS B 99 LYS^? 20.46 O2 GOL A 115 F 35 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 15.40 22.79 16.66 13.93 24.10 15.98 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 19.95 18.98 4.81 18.82 20.94 10.49 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 16.32 15.30 17.19 17.71 14.73 18.69 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 2 3 # 2 A 105 HIS B 60 HIS.? 17.24 O2 AGOL B 114 C 62 LYS B 99 LYS^? 20.46 O2 GOL A 115 F 35 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 15.40 22.79 16.66 13.93 24.10 15.98 4.96 22.92 58.66 6.72 23.67 59.53 coo 19.95 18.98 4.81 18.82 20.94 10.49 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 16.32 15.30 17.19 17.71 14.73 18.69 4.69 24.83 64.29 4.38 25.55 62.31 1f80_c03 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c03 naa= 3 ULMN 3 1f80_c04 ACYL CARRIER PROTEIN user 1 3 # 1 B 62 LYS B 99 LYS^? 20.46 O2 GOL A 115 C 105 HIS A 60 HIS.? 17.72 O2 GOL A 115 D 35 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 38.76 28.25 7.87 36.33 26.41 13.58 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 34.93 19.72 17.37 34.72 18.17 15.98 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 41.01 23.02 20.83 40.65 24.26 22.55 -2.26 2.59 64.84 -3.73 2.30 63.39 1f80_c04 source 1f80 ACYL CARRIER PROTEIN : 1 hits 1f80_c04 naa= 3 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 1 3 # 1 A 62 LYS B 99 LYS^? 20.46 O2 GOL A 115 B 105 HIS B 60 HIS.? 17.24 O2 AGOL B 114 E 35 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 20.51 39.76 8.83 21.23 37.38 14.18 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 27.18 37.56 20.68 29.07 38.28 20.13 4.96 22.92 58.66 6.72 23.67 59.53 coo 19.97 40.39 22.03 18.53 39.30 23.18 4.69 24.83 64.29 4.38 25.55 62.31 1f80_c05 source 1f80 ACYL CARRIER PROTEIN : 1 hits 1f80_c05 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE A 56 PHE.? 19.44 O2 AGOL B 114 A 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 244 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 9.23 46.77 25.11 11.48 48.39 24.76 -3.27 19.66 62.15 -1.03 19.03 60.63 coo 10.51 37.86 19.71 9.07 39.38 20.04 4.69 24.83 64.29 4.38 25.55 62.31 coo -1.20 42.34 17.67 3.19 45.13 19.06 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 112 PHE A 101 PHE^? 15.37 O2 AGOL B 114 A 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 244 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 9.23 46.77 25.11 11.48 48.39 24.76 7.22 14.91 63.43 4.75 15.06 62.17 coo 10.51 37.86 19.71 9.07 39.38 20.04 4.69 24.83 64.29 4.38 25.55 62.31 coo -1.20 42.34 17.67 3.19 45.13 19.06 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 A 112 PHE B 94 PHE~? 11.42 O3 AGOL B 114 A 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 244 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 9.23 46.77 25.11 11.48 48.39 24.76 1.02 29.70 71.33 1.10 27.58 73.12 coo 10.51 37.86 19.71 9.07 39.38 20.04 4.69 24.83 64.29 4.38 25.55 62.31 coo -1.20 42.34 17.67 3.19 45.13 19.06 -4.67 17.57 66.69 -7.33 13.35 64.02 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 3 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE A 56 PHE.? 19.44 O2 AGOL B 114 B 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 244 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 8.76 47.85 34.91 11.08 46.36 35.41 -3.27 19.66 62.15 -1.03 19.03 60.63 coo 9.06 56.85 40.30 7.71 55.27 39.90 4.69 24.83 64.29 4.38 25.55 62.31 coo -2.38 51.82 41.62 2.07 49.19 40.42 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 112 PHE A 101 PHE^? 15.37 O2 AGOL B 114 B 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 244 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 8.76 47.85 34.91 11.08 46.36 35.41 7.22 14.91 63.43 4.75 15.06 62.17 coo 9.06 56.85 40.30 7.71 55.27 39.90 4.69 24.83 64.29 4.38 25.55 62.31 coo -2.38 51.82 41.62 2.07 49.19 40.42 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 B 112 PHE B 94 PHE~? 11.42 O3 AGOL B 114 B 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 244 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 8.76 47.85 34.91 11.08 46.36 35.41 1.02 29.70 71.33 1.10 27.58 73.12 coo 9.06 56.85 40.30 7.71 55.27 39.90 4.69 24.83 64.29 4.38 25.55 62.31 coo -2.38 51.82 41.62 2.07 49.19 40.42 -4.67 17.57 66.69 -7.33 13.35 64.02 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 3 hits 1fc4_c03 naa= 3 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 136 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 244 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 11.28 44.53 18.60 9.91 46.00 19.20 4.96 22.92 58.66 6.72 23.67 59.53 coo 10.51 37.86 19.71 9.07 39.38 20.04 4.69 24.83 64.29 4.38 25.55 62.31 coo -1.20 42.34 17.67 3.19 45.13 19.06 -4.67 17.57 66.69 -7.33 13.35 64.02 1fc4_c04 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 1 hits 1fc4_c04 naa= 3 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 136 HIS B 60 HIS.? 17.24 O2 AGOL B 114 B 210 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 244 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 10.08 50.18 41.78 8.91 48.61 41.04 4.96 22.92 58.66 6.72 23.67 59.53 coo 9.06 56.85 40.30 7.71 55.27 39.90 4.69 24.83 64.29 4.38 25.55 62.31 coo -2.38 51.82 41.62 2.07 49.19 40.42 -4.67 17.57 66.69 -7.33 13.35 64.02 1fc4_c05 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 1 hits 1fc4_c05 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 142 LEU A 4 LEU^? 15.07 O2 AGOL B 114 A 165 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 11.79 2.97 71.53 9.83 2.65 69.55 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 13.63 10.81 66.40 15.28 11.44 65.10 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 142 LEU A 5 LEU^? 12.71 O1 GOL A 115 A 165 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 11.79 2.97 71.53 9.83 2.65 69.55 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 8.14 12.29 67.68 5.99 12.37 68.23 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 137 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 142 LEU B 4 LEU^? 15.38 O2 GOL A 115 A 165 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 2.56 21.42 79.08 2.05 22.43 76.53 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 -3.63 14.56 76.39 -5.64 14.13 77.16 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 A 137 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 142 LEU B 5 LEU^? 12.64 O2 GOL A 115 A 165 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 2.56 21.42 79.08 2.05 22.43 76.53 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 0.30 13.37 72.30 2.33 13.12 71.55 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 3.47 17.87 83.94 8.53 16.31 82.03 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 39 TYR^? 6.40 O1 GOL A 115 B 142 LEU A 5 LEU^? 12.71 O1 GOL A 115 B 165 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 11.79 2.97 71.53 9.83 2.65 69.55 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 8.14 12.29 67.68 5.99 12.37 68.23 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 142 LEU B 5 LEU^? 12.64 O2 GOL A 115 B 165 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 2.56 21.42 79.08 2.05 22.43 76.53 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 0.30 13.37 72.30 2.33 13.12 71.55 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 3.47 17.87 83.94 8.53 16.31 82.03 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR A 39 TYR^? 6.40 O1 GOL A 115 C 142 LEU A 5 LEU^? 12.71 O1 GOL A 115 C 165 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 11.79 2.97 71.53 9.83 2.65 69.55 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 8.14 12.29 67.68 5.99 12.37 68.23 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 137 TYR B 39 TYR^? 6.45 O3 AGOL B 114 C 142 LEU B 5 LEU^? 12.64 O2 GOL A 115 C 165 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 2.56 21.42 79.08 2.05 22.43 76.53 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 0.30 13.37 72.30 2.33 13.12 71.55 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 3.47 17.87 83.94 8.53 16.31 82.03 1fdy_c02 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c02 naa= 3 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 137 TYR A 39 TYR^? 6.40 O1 GOL A 115 D 142 LEU A 5 LEU^? 12.71 O1 GOL A 115 D 165 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 11.79 2.97 71.53 9.83 2.65 69.55 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 8.14 12.29 67.68 5.99 12.37 68.23 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR B 39 TYR^? 6.45 O3 AGOL B 114 D 142 LEU B 5 LEU^? 12.64 O2 GOL A 115 D 165 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 2.56 21.42 79.08 2.05 22.43 76.53 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 0.30 13.37 72.30 2.33 13.12 71.55 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 3.47 17.87 83.94 8.53 16.31 82.03 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c03 naa= 3 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 # 1 A 94 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 198 CYH A 67 CYH^? 10.62 O1 GOL A 115 A 206 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 49.92 26.66 0.19 51.26 25.02 0.19 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 51.25 11.31 6.04 51.91 8.58 5.83 13.60 7.87 70.43 13.69 6.07 68.33 coo 38.98 17.42 20.63 38.42 14.68 20.70 0.03 16.72 79.11 -1.50 18.92 78.46 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 2 3 # 2 A 94 GLU A 46 GLU^? 17.99 O2 GOL A 115 A 198 CYH B 67 CYH^? 10.77 O3 AGOL B 114 A 206 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 49.92 26.66 0.19 51.26 25.02 0.19 -10.58 9.40 72.08 -11.31 10.55 73.74 coo 51.25 11.31 6.04 51.91 8.58 5.83 0.03 16.72 79.11 -1.50 18.92 78.46 coo 38.98 17.42 20.63 38.42 14.68 20.70 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 3 3 # 3 A 94 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 198 CYH B 67 CYH^? 10.77 O3 AGOL B 114 A 206 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 49.92 26.66 0.19 51.26 25.02 0.19 7.99 29.80 81.55 8.79 31.72 80.96 coo 51.25 11.31 6.04 51.91 8.58 5.83 0.03 16.72 79.11 -1.50 18.92 78.46 coo 38.98 17.42 20.63 38.42 14.68 20.70 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 4 3 # 4 A 94 GLU B 46 GLU^? 18.15 O2 AGOL B 114 A 198 CYH A 67 CYH^? 10.62 O1 GOL A 115 A 206 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 49.92 26.66 0.19 51.26 25.02 0.19 14.18 17.59 59.29 15.88 16.34 59.02 coo 51.25 11.31 6.04 51.91 8.58 5.83 13.60 7.87 70.43 13.69 6.07 68.33 coo 38.98 17.42 20.63 38.42 14.68 20.70 0.03 16.72 79.11 -1.50 18.92 78.46 1ff3_c00 source 1ff3 PEPTIDE METHIONINE SULFOXIDE REDUCTASE : 4 hits 1ff3_c00 naa= 3 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 # 1 A 94 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 198 CYH A 67 CYH^? 10.62 O1 GOL A 115 A 206 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 49.92 26.66 0.19 51.26 25.02 0.19 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 51.25 11.31 6.04 51.91 8.58 5.83 13.60 7.87 70.43 13.69 6.07 68.33 coo 38.98 17.42 20.63 38.42 14.68 20.70 0.03 16.72 79.11 -1.50 18.92 78.46 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 2 3 # 2 A 94 GLU A 46 GLU^? 17.99 O2 GOL A 115 A 198 CYH B 67 CYH^? 10.77 O3 AGOL B 114 A 206 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 49.92 26.66 0.19 51.26 25.02 0.19 -10.58 9.40 72.08 -11.31 10.55 73.74 coo 51.25 11.31 6.04 51.91 8.58 5.83 0.03 16.72 79.11 -1.50 18.92 78.46 coo 38.98 17.42 20.63 38.42 14.68 20.70 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 3 3 # 3 A 94 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 198 CYH B 67 CYH^? 10.77 O3 AGOL B 114 A 206 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 49.92 26.66 0.19 51.26 25.02 0.19 7.99 29.80 81.55 8.79 31.72 80.96 coo 51.25 11.31 6.04 51.91 8.58 5.83 0.03 16.72 79.11 -1.50 18.92 78.46 coo 38.98 17.42 20.63 38.42 14.68 20.70 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 4 3 # 4 A 94 GLU B 46 GLU^? 18.15 O2 AGOL B 114 A 198 CYH A 67 CYH^? 10.62 O1 GOL A 115 A 206 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 49.92 26.66 0.19 51.26 25.02 0.19 14.18 17.59 59.29 15.88 16.34 59.02 coo 51.25 11.31 6.04 51.91 8.58 5.83 13.60 7.87 70.43 13.69 6.07 68.33 coo 38.98 17.42 20.63 38.42 14.68 20.70 0.03 16.72 79.11 -1.50 18.92 78.46 1ff3_c01 source 1ff3 PEPTIDE METHIONINE SULFOXIDE REDUCTASE : 4 hits 1ff3_c01 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 3 ARG^? 7.23 O2 AGOL B 114 A 136 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 246 GLU A 66 GLU^? 10.35 O1 GOL A 115 coo 13.48 30.30 107.06 11.75 30.99 109.44 13.50 14.36 73.75 10.91 14.83 75.22 coo 9.46 32.37 115.82 8.50 34.20 115.47 7.17 5.83 75.53 6.75 7.34 76.93 coo 11.99 34.33 109.92 10.08 34.19 110.77 10.15 10.32 71.63 9.22 11.91 72.68 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 136 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 246 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 13.48 30.30 107.06 11.75 30.99 109.44 2.91 6.62 75.93 0.97 5.83 78.22 coo 9.46 32.37 115.82 8.50 34.20 115.47 10.15 10.32 71.63 9.22 11.91 72.68 coo 11.99 34.33 109.92 10.08 34.19 110.77 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG B 3 ARG^? 7.55 O2 GOL A 115 A 136 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 246 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo 13.48 30.30 107.06 11.75 30.99 109.44 2.10 9.57 79.57 4.68 9.08 78.05 coo 9.46 32.37 115.82 8.50 34.20 115.47 8.17 18.37 77.00 9.28 16.58 76.89 coo 11.99 34.33 109.92 10.08 34.19 110.77 2.66 14.38 76.39 3.95 12.75 76.00 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 136 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 246 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 13.48 30.30 107.06 11.75 30.99 109.44 10.15 17.42 72.76 8.76 14.87 71.71 coo 9.46 32.37 115.82 8.50 34.20 115.47 2.66 14.38 76.39 3.95 12.75 76.00 coo 11.99 34.33 109.92 10.08 34.19 110.77 8.17 18.37 77.00 9.28 16.58 76.89 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 4 hits 1fhl_c00 naa= 3 ULMN 3 1fo6_c00 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 A 47 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 127 LYS A 10 LYS.? 17.78 O2 GOL A 115 A 172 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 14.84 17.73 17.72 12.66 18.02 17.60 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 13.59 13.62 10.66 10.48 17.11 15.01 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo 10.73 13.80 18.28 9.65 16.43 18.61 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1fo6_c00 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 2 3 # 2 A 47 GLU B 22 GLU~? 14.39 O1 BGOL B 114 A 127 LYS B 10 LYS.? 17.18 O2 BGOL B 114 A 172 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo 14.84 17.73 17.72 12.66 18.02 17.60 3.40 33.72 72.05 2.78 34.87 73.76 coo 13.59 13.62 10.66 10.48 17.11 15.01 1.10 28.15 64.50 5.88 30.75 61.34 coo 10.73 13.80 18.28 9.65 16.43 18.61 5.26 28.04 73.57 5.28 26.63 71.09 1fo6_c00 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 2 hits 1fo6_c00 naa= 3 ULMN 3 1fo6_c01 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 B 47 GLU A 22 GLU~? 14.62 C1 GOL A 115 B 127 LYS A 10 LYS.? 17.78 O2 GOL A 115 B 172 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo -11.43 -15.11 20.71 -9.41 -15.34 21.12 3.69 -7.10 65.54 5.12 -8.60 65.19 coo -8.59 -13.62 12.98 -6.65 -15.32 18.82 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo -7.53 -11.08 20.68 -6.56 -13.38 22.13 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1fo6_c01 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 2 3 # 2 B 47 GLU B 22 GLU~? 14.39 O1 BGOL B 114 B 127 LYS B 10 LYS.? 17.18 O2 BGOL B 114 B 172 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo -11.43 -15.11 20.71 -9.41 -15.34 21.12 3.40 33.72 72.05 2.78 34.87 73.76 coo -8.59 -13.62 12.98 -6.65 -15.32 18.82 1.10 28.15 64.50 5.88 30.75 61.34 coo -7.53 -11.08 20.68 -6.56 -13.38 22.13 5.26 28.04 73.57 5.28 26.63 71.09 1fo6_c01 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 2 hits 1fo6_c01 naa= 3 ULMN 3 1fo6_c02 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 C 47 GLU A 22 GLU~? 14.62 C1 GOL A 115 C 127 LYS A 10 LYS.? 17.78 O2 GOL A 115 C 172 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo -14.75 22.68 45.73 -12.65 22.97 45.86 3.69 -7.10 65.54 5.12 -8.60 65.19 coo -13.46 21.30 53.90 -10.36 22.98 48.58 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo -10.67 18.91 46.59 -9.50 21.20 45.39 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1fo6_c02 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 2 3 # 2 C 47 GLU B 22 GLU~? 14.39 O1 BGOL B 114 C 127 LYS B 10 LYS.? 17.18 O2 BGOL B 114 C 172 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo -14.75 22.68 45.73 -12.65 22.97 45.86 3.40 33.72 72.05 2.78 34.87 73.76 coo -13.46 21.30 53.90 -10.36 22.98 48.58 1.10 28.15 64.50 5.88 30.75 61.34 coo -10.67 18.91 46.59 -9.50 21.20 45.39 5.26 28.04 73.57 5.28 26.63 71.09 1fo6_c02 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 2 hits 1fo6_c02 naa= 3 ULMN 3 1fo6_c03 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 D 47 GLU A 22 GLU~? 14.62 C1 GOL A 115 D 127 LYS A 10 LYS.? 17.78 O2 GOL A 115 D 172 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 11.48 -9.38 54.24 9.40 -9.76 53.86 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 8.59 -5.45 60.90 6.67 -8.84 55.89 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo 7.45 -5.79 52.90 6.67 -8.39 52.10 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1fo6_c03 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 2 3 # 2 D 47 GLU B 22 GLU~? 14.39 O1 BGOL B 114 D 127 LYS B 10 LYS.? 17.18 O2 BGOL B 114 D 172 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo 11.48 -9.38 54.24 9.40 -9.76 53.86 3.40 33.72 72.05 2.78 34.87 73.76 coo 8.59 -5.45 60.90 6.67 -8.84 55.89 1.10 28.15 64.50 5.88 30.75 61.34 coo 7.45 -5.79 52.90 6.67 -8.39 52.10 5.26 28.04 73.57 5.28 26.63 71.09 1fo6_c03 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 2 hits 1fo6_c03 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 3 ARG^? 7.23 O2 AGOL B 114 A 136 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 246 GLU A 66 GLU^? 10.35 O1 GOL A 115 coo 13.94 29.84 106.80 11.67 30.40 108.79 13.50 14.36 73.75 10.91 14.83 75.22 coo 9.52 31.97 115.23 8.45 33.74 114.72 7.17 5.83 75.53 6.75 7.34 76.93 coo 11.92 33.82 109.35 10.10 33.50 110.39 10.15 10.32 71.63 9.22 11.91 72.68 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 136 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 246 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 13.94 29.84 106.80 11.67 30.40 108.79 2.91 6.62 75.93 0.97 5.83 78.22 coo 9.52 31.97 115.23 8.45 33.74 114.72 10.15 10.32 71.63 9.22 11.91 72.68 coo 11.92 33.82 109.35 10.10 33.50 110.39 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG B 3 ARG^? 7.55 O2 GOL A 115 A 136 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 246 GLU B 66 GLU^? 10.26 O3 BGOL B 114 coo 13.94 29.84 106.80 11.67 30.40 108.79 2.10 9.57 79.57 4.68 9.08 78.05 coo 9.52 31.97 115.23 8.45 33.74 114.72 8.17 18.37 77.00 9.28 16.58 76.89 coo 11.92 33.82 109.35 10.10 33.50 110.39 2.66 14.38 76.39 3.95 12.75 76.00 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 136 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 246 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo 13.94 29.84 106.80 11.67 30.40 108.79 10.15 17.42 72.76 8.76 14.87 71.71 coo 9.52 31.97 115.23 8.45 33.74 114.72 2.66 14.38 76.39 3.95 12.75 76.00 coo 11.92 33.82 109.35 10.10 33.50 110.39 8.17 18.37 77.00 9.28 16.58 76.89 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 4 hits 1fob_c00 naa= 3 ULMN 3 1fuq_c00 FUMARASE C user 1 3 # 1 A 324 LYS A 38 LYS^? 8.53 O1 GOL A 115 A 331 GLU A 28 GLU~? 9.11 C3 GOL A 115 B 188 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 130.22 155.23 83.49 125.21 153.71 84.04 15.57 5.57 75.60 11.35 8.72 79.21 coo 120.90 152.23 75.28 120.94 153.09 77.19 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 122.04 152.80 81.06 120.71 154.37 81.46 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1fuq_c00 FUMARASE C user 2 3 # 2 A 324 LYS B 38 LYS^? 6.81 O3 BGOL B 114 A 331 GLU B 28 GLU~? 8.04 O1 BGOL B 114 B 188 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 130.22 155.23 83.49 125.21 153.71 84.04 3.47 17.87 83.94 8.53 16.31 82.03 coo 120.90 152.23 75.28 120.94 153.09 77.19 7.99 29.80 81.55 8.79 31.72 80.96 coo 122.04 152.80 81.06 120.71 154.37 81.46 5.80 25.06 85.89 7.38 24.42 84.67 1fuq_c00 source 1fuq FUMARASE C : 2 hits 1fuq_c00 naa= 3 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 1 3 # 1 A 197 ARG A 20 ARG~? 7.91 O3 GOL A 115 A 201 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 204 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo -27.47 20.45 37.96 -26.70 17.86 36.51 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo -15.08 14.90 41.58 -16.70 13.64 42.02 10.26 -5.82 64.75 8.54 -6.13 65.90 coo -15.44 20.23 39.72 -16.43 18.87 38.47 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 2 3 # 2 A 197 ARG B 20 ARG~? 7.55 O1 AGOL B 114 A 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -27.47 20.45 37.96 -26.70 17.86 36.51 12.50 29.25 70.09 15.28 27.90 70.29 coo -15.08 14.90 41.58 -16.70 13.64 42.02 -1.03 31.78 76.72 0.89 32.00 75.91 coo -15.44 20.23 39.72 -16.43 18.87 38.47 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 3 3 # 3 A 197 ARG B 84 ARG~? 19.95 O3 AGOL B 114 A 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -27.47 20.45 37.96 -26.70 17.86 36.51 -8.32 22.59 81.65 -10.97 23.53 80.37 coo -15.08 14.90 41.58 -16.70 13.64 42.02 -1.03 31.78 76.72 0.89 32.00 75.91 coo -15.44 20.23 39.72 -16.43 18.87 38.47 0.85 27.13 76.55 -1.16 26.55 76.75 1g8f_c00 source 1g8f SULFATE ADENYLYLTRANSFERASE : 3 hits 1g8f_c00 naa= 3 ULMN 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 1 3 # 1 412 GLU A 22 GLU~? 14.62 C1 GOL A 115 516 HIS A 26 HIS~? 10.00 O1 GOL A 115 559 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 49.01 14.50 52.53 46.99 14.61 52.78 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 41.59 7.83 54.15 41.16 9.87 53.87 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 42.22 14.55 52.50 43.91 14.87 53.60 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 2 3 # 2 412 GLU A 89 GLU~? 16.58 CL CL A 114 516 HIS A 26 HIS~? 10.00 O1 GOL A 115 559 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 49.01 14.50 52.53 46.99 14.61 52.78 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 41.59 7.83 54.15 41.16 9.87 53.87 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 42.22 14.55 52.50 43.91 14.87 53.60 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 3 3 # 3 412 GLU B 22 GLU~? 14.39 O1 BGOL B 114 516 HIS B 26 HIS~? 10.11 O3 AGOL B 114 559 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 49.01 14.50 52.53 46.99 14.61 52.78 3.40 33.72 72.05 2.78 34.87 73.76 coo 41.59 7.83 54.15 41.16 9.87 53.87 0.85 27.13 76.55 -1.16 26.55 76.75 coo 42.22 14.55 52.50 43.91 14.87 53.60 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 4 3 # 4 412 GLU B 89 GLU~? 21.63 O3 AGOL B 114 516 HIS B 26 HIS~? 10.11 O3 AGOL B 114 559 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 49.01 14.50 52.53 46.99 14.61 52.78 -9.38 32.01 77.42 -10.46 31.89 75.58 coo 41.59 7.83 54.15 41.16 9.87 53.87 0.85 27.13 76.55 -1.16 26.55 76.75 coo 42.22 14.55 52.50 43.91 14.87 53.60 -1.03 31.78 76.72 0.89 32.00 75.91 1gal_c00 source 1gal GLUCOSE OXIDASE (E.C.1.1.3.4) : 4 hits 1gal_c00 naa= 3 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 1 3 # 1 160 LYS B 99 LYS^? 20.46 O2 GOL A 115 210 ARG A 3 ARG^? 7.23 O2 AGOL B 114 225 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 17.51 28.50 73.42 17.24 23.02 75.86 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 24.74 11.56 73.05 25.29 14.32 71.80 13.50 14.36 73.75 10.91 14.83 75.22 coo 27.81 15.44 77.10 25.66 16.50 75.19 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS B 99 LYS^? 20.46 O2 GOL A 115 210 ARG B 3 ARG^? 7.55 O2 GOL A 115 225 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 17.51 28.50 73.42 17.24 23.02 75.86 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 24.74 11.56 73.05 25.29 14.32 71.80 2.10 9.57 79.57 4.68 9.08 78.05 coo 27.81 15.44 77.10 25.66 16.50 75.19 2.91 6.62 75.93 0.97 5.83 78.22 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 2 hits 1gsa_c00 naa= 3 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 A 189 PHE A 101 PHE^? 15.37 O2 AGOL B 114 A 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 7.22 14.91 63.43 4.75 15.06 62.17 coo 2.59 0.29 25.55 4.65 0.18 25.07 4.69 24.83 64.29 4.38 25.55 62.31 coo 12.42 6.10 23.27 9.95 1.57 20.16 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 A 189 PHE B 94 PHE~? 11.42 O3 AGOL B 114 A 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 1.02 29.70 71.33 1.10 27.58 73.12 coo 2.59 0.29 25.55 4.65 0.18 25.07 4.69 24.83 64.29 4.38 25.55 62.31 coo 12.42 6.10 23.27 9.95 1.57 20.16 -4.67 17.57 66.69 -7.33 13.35 64.02 1gtx_c00 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c00 naa= 3 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 B 189 PHE A 101 PHE^? 15.37 O2 AGOL B 114 B 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 7.22 14.91 63.43 4.75 15.06 62.17 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 4.69 24.83 64.29 4.38 25.55 62.31 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 B 189 PHE B 94 PHE~? 11.42 O3 AGOL B 114 B 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 1.02 29.70 71.33 1.10 27.58 73.12 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 4.69 24.83 64.29 4.38 25.55 62.31 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 -4.67 17.57 66.69 -7.33 13.35 64.02 1gtx_c01 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c01 naa= 3 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 C 189 PHE A 101 PHE^? 15.37 O2 AGOL B 114 C 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 17.41 60.57 64.39 18.40 58.12 65.34 7.22 14.91 63.43 4.75 15.06 62.17 coo 24.10 66.43 63.33 24.18 64.30 63.40 4.69 24.83 64.29 4.38 25.55 62.31 coo 27.64 56.61 58.17 22.18 57.92 60.36 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 C 189 PHE B 94 PHE~? 11.42 O3 AGOL B 114 C 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 17.41 60.57 64.39 18.40 58.12 65.34 1.02 29.70 71.33 1.10 27.58 73.12 coo 24.10 66.43 63.33 24.18 64.30 63.40 4.69 24.83 64.29 4.38 25.55 62.31 coo 27.64 56.61 58.17 22.18 57.92 60.36 -4.67 17.57 66.69 -7.33 13.35 64.02 1gtx_c02 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c02 naa= 3 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 D 189 PHE A 101 PHE^? 15.37 O2 AGOL B 114 D 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 D 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 35.44 53.35 83.81 35.65 54.53 81.28 7.22 14.91 63.43 4.75 15.06 62.17 coo 29.72 46.46 83.60 30.79 47.36 81.99 4.69 24.83 64.29 4.38 25.55 62.31 coo 36.89 44.91 74.55 37.33 48.94 79.01 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 D 189 PHE B 94 PHE~? 11.42 O3 AGOL B 114 D 298 ASP B 62 ASP.? 15.08 O2 BGOL B 114 D 329 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 35.44 53.35 83.81 35.65 54.53 81.28 1.02 29.70 71.33 1.10 27.58 73.12 coo 29.72 46.46 83.60 30.79 47.36 81.99 4.69 24.83 64.29 4.38 25.55 62.31 coo 36.89 44.91 74.55 37.33 48.94 79.01 -4.67 17.57 66.69 -7.33 13.35 64.02 1gtx_c03 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c03 naa= 3 ULMN 3 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 1 3 # 1 B 151 SER A 30 SER~? 7.32 O1 GOL A 115 B 164 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 168 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 13.08 50.93 56.67 13.12 48.99 55.27 15.10 -1.32 71.94 13.61 -0.13 73.45 coo 11.52 46.03 51.32 10.06 47.90 52.76 11.79 2.97 71.53 9.83 2.65 69.55 coo 15.72 50.86 51.22 10.77 52.35 51.39 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 # 2 B 151 SER B 30 SER~? 7.11 O3 AGOL B 114 B 164 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 168 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 13.08 50.93 56.67 13.12 48.99 55.27 1.68 25.09 82.95 3.64 23.84 82.25 coo 11.52 46.03 51.32 10.06 47.90 52.76 2.56 21.42 79.08 2.05 22.43 76.53 coo 15.72 50.86 51.22 10.77 52.35 51.39 3.47 17.87 83.94 8.53 16.31 82.03 1gz6_c01 source 1gz6 ESTRADIOL 17 BETA-DEHYDROGENASE 4 : 2 hits 1gz6_c01 naa= 3 ULMN 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 1 3 # 1 C 151 SER A 30 SER~? 7.32 O1 GOL A 115 C 164 TYR A 39 TYR^? 6.40 O1 GOL A 115 C 168 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 11.22 34.38 82.32 11.07 36.29 83.78 15.10 -1.32 71.94 13.61 -0.13 73.45 coo 8.83 39.27 87.38 7.60 37.43 85.69 11.79 2.97 71.53 9.83 2.65 69.55 coo 12.98 34.46 88.14 8.11 32.96 87.14 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 # 2 C 151 SER B 30 SER~? 7.11 O3 AGOL B 114 C 164 TYR B 39 TYR^? 6.45 O3 AGOL B 114 C 168 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 11.22 34.38 82.32 11.07 36.29 83.78 1.68 25.09 82.95 3.64 23.84 82.25 coo 8.83 39.27 87.38 7.60 37.43 85.69 2.56 21.42 79.08 2.05 22.43 76.53 coo 12.98 34.46 88.14 8.11 32.96 87.14 3.47 17.87 83.94 8.53 16.31 82.03 1gz6_c02 source 1gz6 ESTRADIOL 17 BETA-DEHYDROGENASE 4 : 2 hits 1gz6_c02 naa= 3 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 1 3 # 1 A 271 GLN A 47 GLN.? 16.75 O2 GOL A 115 A 296 GLU A 46 GLU^? 17.99 O2 GOL A 115 A 383 TYR B 6 TYR^? 13.17 O3 AGOL B 114 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 -6.91 9.36 67.07 -6.32 8.53 65.16 coo 40.93 4.45 2.36 38.91 3.75 2.26 -10.58 9.40 72.08 -11.31 10.55 73.74 coo 30.54 7.22 6.23 31.38 5.79 3.97 -2.31 18.55 72.58 -4.15 18.18 74.66 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 2 3 # 2 A 271 GLN B 47 GLN.? 17.09 O2 AGOL B 114 A 296 GLU B 46 GLU^? 18.15 O2 AGOL B 114 A 383 TYR A 6 TYR^? 13.03 O1 GOL A 115 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 7.79 18.62 60.03 5.90 19.35 59.41 coo 40.93 4.45 2.36 38.91 3.75 2.26 14.18 17.59 59.29 15.88 16.34 59.02 coo 30.54 7.22 6.23 31.38 5.79 3.97 9.35 7.19 64.40 12.10 6.95 63.91 1h19_c00 source 1h19 LEUKOTRIENE A-4 HYDROLASE : 2 hits 1h19_c00 naa= 3 ULMN 3 1h2r_c00 PERIPLASMIC [NIFE] HYDROGENASE LARGEuser 1 3 # 1 S 18 THR A 18 THR~? 16.16 O3 GOL A 115 L 34 GLU A 22 GLU~? 14.62 C1 GOL A 115 L 546 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 59.66 41.78 78.85 58.82 40.81 80.62 -0.94 -8.43 66.77 -0.62 -9.76 65.12 coo 58.67 42.52 83.67 60.77 42.68 84.14 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 58.67 44.02 88.31 58.41 45.45 86.02 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1h2r_c00 PERIPLASMIC [NIFE] HYDROGENASE LARGEuser 2 3 # 2 S 18 THR B 18 THR~? 16.12 O1 AGOL B 114 L 34 GLU B 22 GLU~? 14.39 O1 BGOL B 114 L 546 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo 59.66 41.78 78.85 58.82 40.81 80.62 6.90 34.71 68.43 5.56 36.36 68.22 coo 58.67 42.52 83.67 60.77 42.68 84.14 3.40 33.72 72.05 2.78 34.87 73.76 coo 58.67 44.02 88.31 58.41 45.45 86.02 5.26 28.04 73.57 5.28 26.63 71.09 ULMN 3 1h2r_c00 PERIPLASMIC [NIFE] HYDROGENASE LARGEuser 3 3 # 3 S 18 THR B 93 THR~? 17.37 O3 AGOL B 114 L 34 GLU B 22 GLU~? 14.39 O1 BGOL B 114 L 546 CYH B 23 CYH~? 8.19 O2 BGOL B 114 coo 59.66 41.78 78.85 58.82 40.81 80.62 -2.97 33.11 71.20 -2.14 34.67 72.49 coo 58.67 42.52 83.67 60.77 42.68 84.14 3.40 33.72 72.05 2.78 34.87 73.76 coo 58.67 44.02 88.31 58.41 45.45 86.02 5.26 28.04 73.57 5.28 26.63 71.09 1h2r_c00 source 1h2r PERIPLASMIC [NIFE] HYDROGENASE LARGE SUBUNIT : 3 hits 1h2r_c00 naa= 3 ULMN 3 1hy3_c00 ESTROGEN SULFOTRANSFERASE user 1 3 # 1 A 47 LYS B 85 LYS~? 25.09 O3 AGOL B 114 A 107 HIS A 52 HIS.? 19.33 O3 AGOL B 114 A 137 SER B 81 SER~? 19.76 O3 AGOL B 114 coo 5.11 -0.55 31.43 1.36 1.90 33.24 -9.57 27.75 81.15 -15.18 26.42 83.82 coo 6.14 -0.73 24.01 6.05 0.83 25.40 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 1.06 -1.40 35.67 2.72 0.28 35.10 -10.56 24.73 86.75 -8.28 25.51 87.05 1hy3_c00 source 1hy3 ESTROGEN SULFOTRANSFERASE : 1 hits 1hy3_c00 naa= 3 ULMN 3 1hy3_c01 ESTROGEN SULFOTRANSFERASE user 1 3 # 1 B 47 LYS B 85 LYS~? 25.09 O3 AGOL B 114 B 107 HIS A 52 HIS.? 19.33 O3 AGOL B 114 B 137 SER B 81 SER~? 19.76 O3 AGOL B 114 coo -20.15 -16.49 60.11 -21.92 -14.52 56.18 -9.57 27.75 81.15 -15.18 26.42 83.82 coo -23.43 -14.78 66.71 -24.10 -15.65 64.93 -10.73 25.66 73.06 -8.90 25.80 74.09 coo -17.90 -14.30 55.11 -19.49 -15.96 55.90 -10.56 24.73 86.75 -8.28 25.51 87.05 1hy3_c01 source 1hy3 ESTROGEN SULFOTRANSFERASE : 1 hits 1hy3_c01 naa= 3 ULMN 3 1i29_c01 CSDB user 1 3 # 1 A 123 HIS A 60 HIS.? 17.72 O2 GOL A 115 A 200 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 226 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 23.24 46.58 4.39 24.43 46.59 2.66 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 24.51 43.28 11.18 25.17 44.50 9.58 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 34.47 51.09 7.19 28.58 51.18 7.53 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1i29_c01 CSDB user 2 3 # 2 A 123 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 200 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 226 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 23.24 46.58 4.39 24.43 46.59 2.66 4.96 22.92 58.66 6.72 23.67 59.53 coo 24.51 43.28 11.18 25.17 44.50 9.58 4.69 24.83 64.29 4.38 25.55 62.31 coo 34.47 51.09 7.19 28.58 51.18 7.53 -4.67 17.57 66.69 -7.33 13.35 64.02 1i29_c01 source 1i29 CSDB : 2 hits 1i29_c01 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 61 VAL.? 15.24 O2 GOL A 115 A 200 ASP A 57 ASP.? 26.60 O2 GOL A 115 A 226 LYS B 10 LYS.? 17.18 O2 BGOL B 114 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -2.51 7.19 63.49 -1.05 8.73 64.01 coo 24.51 43.28 11.18 25.17 44.50 9.58 -7.42 17.52 58.35 -7.76 15.77 57.13 coo 34.47 51.09 7.19 28.58 51.18 7.53 1.10 28.15 64.50 5.88 30.75 61.34 ULMN 3 1i29_c03 CSDB user 2 3 # 2 A 128 VAL A 106 VAL.? -3.69 O2 BGOL B 114s A 200 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 226 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 19.13 38.05 1.41 19.72 38.80 -0.53 11.60 25.74 73.20 9.53 25.42 73.82 coo 24.51 43.28 11.18 25.17 44.50 9.58 4.69 24.83 64.29 4.38 25.55 62.31 coo 34.47 51.09 7.19 28.58 51.18 7.53 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 1i29_c03 CSDB user 3 3 # 3 A 128 VAL B 106 VAL.? -3.83 O3 GOL A 115s A 200 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 226 LYS A 99 LYS.? 18.44 CL CL A 114 coo 19.13 38.05 1.41 19.72 38.80 -0.53 1.31 -1.09 74.75 3.06 -0.73 73.51 coo 24.51 43.28 11.18 25.17 44.50 9.58 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 34.47 51.09 7.19 28.58 51.18 7.53 10.32 8.81 58.96 14.77 8.28 57.43 ULMN 3 1i29_c03 CSDB user 4 3 # 4 A 128 VAL B 106 VAL.? -3.83 O3 GOL A 115s A 200 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 226 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 19.13 38.05 1.41 19.72 38.80 -0.53 1.31 -1.09 74.75 3.06 -0.73 73.51 coo 24.51 43.28 11.18 25.17 44.50 9.58 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 34.47 51.09 7.19 28.58 51.18 7.53 -4.67 17.57 66.69 -7.33 13.35 64.02 1i29_c03 source 1i29 CSDB : 4 hits 1i29_c03 naa= 3 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 # 1 A 14 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 61 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 162 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 3.69 -7.10 65.54 5.12 -8.60 65.19 coo -4.89 20.85 5.22 -3.95 21.69 6.91 9.84 -6.23 75.42 9.01 -8.17 75.63 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 # 2 A 14 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 61 GLU A 89 GLU~? 16.58 CL CL A 114 A 162 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 3.69 -7.10 65.54 5.12 -8.60 65.19 coo -4.89 20.85 5.22 -3.95 21.69 6.91 13.52 -6.00 58.57 12.62 -5.23 56.79 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 3 3 # 3 A 14 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 61 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 162 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 9.84 -6.23 75.42 9.01 -8.17 75.63 coo -4.89 20.85 5.22 -3.95 21.69 6.91 7.17 5.83 75.53 6.75 7.34 76.93 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 4 3 # 4 A 14 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 61 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 162 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 9.84 -6.23 75.42 9.01 -8.17 75.63 coo -4.89 20.85 5.22 -3.95 21.69 6.91 7.17 5.83 75.53 6.75 7.34 76.93 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 5 3 # 5 A 14 GLU B 22 GLU~? 14.39 O1 BGOL B 114 A 61 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 162 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 3.40 33.72 72.05 2.78 34.87 73.76 coo -4.89 20.85 5.22 -3.95 21.69 6.91 7.99 29.80 81.55 8.79 31.72 80.96 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 6 3 # 6 A 14 GLU B 22 GLU~? 14.39 O1 BGOL B 114 A 61 GLU B 89 GLU~? 21.63 O3 AGOL B 114 A 162 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 3.40 33.72 72.05 2.78 34.87 73.76 coo -4.89 20.85 5.22 -3.95 21.69 6.91 -9.38 32.01 77.42 -10.46 31.89 75.58 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 7 3 # 7 A 14 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 61 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 162 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 7.99 29.80 81.55 8.79 31.72 80.96 coo -4.89 20.85 5.22 -3.95 21.69 6.91 8.17 18.37 77.00 9.28 16.58 76.89 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 5.80 25.06 85.89 7.38 24.42 84.67 1j53_c00 source 1j53 DNA POLYMERASE III, EPSILON CHAIN : 7 hits 1j53_c00 naa= 3 ULMN 3 1j70_c00 ATP SULPHURYLASE user 1 3 # 1 A 197 ARG A 20 ARG~? 7.91 O3 GOL A 115 A 201 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 204 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 10.26 -5.82 64.75 8.54 -6.13 65.90 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1j70_c00 ATP SULPHURYLASE user 2 3 # 2 A 197 ARG B 20 ARG~? 7.55 O1 AGOL B 114 A 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 12.50 29.25 70.09 15.28 27.90 70.29 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 -1.03 31.78 76.72 0.89 32.00 75.91 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1j70_c00 ATP SULPHURYLASE user 3 3 # 3 A 197 ARG B 84 ARG~? 19.95 O3 AGOL B 114 A 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 -8.32 22.59 81.65 -10.97 23.53 80.37 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 -1.03 31.78 76.72 0.89 32.00 75.91 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 0.85 27.13 76.55 -1.16 26.55 76.75 1j70_c00 source 1j70 ATP SULPHURYLASE : 3 hits 1j70_c00 naa= 3 ULMN 3 1j70_c01 ATP SULPHURYLASE user 1 3 # 1 B 197 ARG A 20 ARG~? 7.91 O3 GOL A 115 B 201 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 204 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo -18.85 104.93 27.44 -18.03 106.58 29.88 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo -8.48 114.03 24.38 -10.47 114.55 23.97 10.26 -5.82 64.75 8.54 -6.13 65.90 coo -6.99 108.94 26.28 -8.54 109.57 27.55 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1j70_c01 ATP SULPHURYLASE user 2 3 # 2 B 197 ARG B 20 ARG~? 7.55 O1 AGOL B 114 B 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -18.85 104.93 27.44 -18.03 106.58 29.88 12.50 29.25 70.09 15.28 27.90 70.29 coo -8.48 114.03 24.38 -10.47 114.55 23.97 -1.03 31.78 76.72 0.89 32.00 75.91 coo -6.99 108.94 26.28 -8.54 109.57 27.55 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1j70_c01 ATP SULPHURYLASE user 3 3 # 3 B 197 ARG B 84 ARG~? 19.95 O3 AGOL B 114 B 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -18.85 104.93 27.44 -18.03 106.58 29.88 -8.32 22.59 81.65 -10.97 23.53 80.37 coo -8.48 114.03 24.38 -10.47 114.55 23.97 -1.03 31.78 76.72 0.89 32.00 75.91 coo -6.99 108.94 26.28 -8.54 109.57 27.55 0.85 27.13 76.55 -1.16 26.55 76.75 1j70_c01 source 1j70 ATP SULPHURYLASE : 3 hits 1j70_c01 naa= 3 ULMN 3 1j70_c02 ATP SULPHURYLASE user 1 3 # 1 C 197 ARG A 20 ARG~? 7.91 O3 GOL A 115 C 201 HIS A 90 HIS~? 13.16 C1 GOL A 115 C 204 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 30.92 14.23 15.70 28.82 13.90 13.48 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo 20.16 5.55 18.86 20.00 7.59 19.34 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 24.92 3.29 16.90 24.41 4.92 15.69 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1j70_c02 ATP SULPHURYLASE user 2 3 # 2 C 197 ARG B 20 ARG~? 7.55 O1 AGOL B 114 C 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 C 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 30.92 14.23 15.70 28.82 13.90 13.48 12.50 29.25 70.09 15.28 27.90 70.29 coo 20.16 5.55 18.86 20.00 7.59 19.34 -1.03 31.78 76.72 0.89 32.00 75.91 coo 24.92 3.29 16.90 24.41 4.92 15.69 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1j70_c02 ATP SULPHURYLASE user 3 3 # 3 C 197 ARG B 84 ARG~? 19.95 O3 AGOL B 114 C 201 HIS B 90 HIS~? 13.22 O3 AGOL B 114 C 204 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 30.92 14.23 15.70 28.82 13.90 13.48 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 20.16 5.55 18.86 20.00 7.59 19.34 -1.03 31.78 76.72 0.89 32.00 75.91 coo 24.92 3.29 16.90 24.41 4.92 15.69 0.85 27.13 76.55 -1.16 26.55 76.75 1j70_c02 source 1j70 ATP SULPHURYLASE : 3 hits 1j70_c02 naa= 3 ULMN 3 1joa_c00 NADH PEROXIDASE user 1 3 # 1 10 HIS B 90 HIS~? 13.22 O3 AGOL B 114 41 SER B 30 SER~? 7.11 O3 AGOL B 114 303 ARG B 25 ARG~? 13.22 O1 BGOL B 114 coo 62.94 54.74 73.45 64.13 56.17 74.27 -1.03 31.78 76.72 0.89 32.00 75.91 coo 65.67 62.51 70.93 64.56 61.94 68.74 1.68 25.09 82.95 3.64 23.84 82.25 coo 63.38 52.38 77.01 66.48 52.75 76.49 3.18 34.46 77.89 5.47 36.12 76.56 1joa_c00 source 1joa NADH PEROXIDASE : 1 hits 1joa_c00 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 A 258 ARG A 102 ARG^? 13.83 O2 AGOL B 114 coo 42.33 1.56 26.99 42.38 2.91 28.66 10.15 10.32 71.63 9.22 11.91 72.68 coo 38.45 -0.44 19.89 37.36 0.90 25.90 15.57 5.57 75.60 11.35 8.72 79.21 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 16.77 16.26 64.57 17.43 19.14 63.66 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 A 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 A 258 ARG B 3 ARG^? 7.55 O2 GOL A 115 coo 42.33 1.56 26.99 42.38 2.91 28.66 10.15 10.32 71.63 9.22 11.91 72.68 coo 38.45 -0.44 19.89 37.36 0.90 25.90 15.57 5.57 75.60 11.35 8.72 79.21 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 2.10 9.57 79.57 4.68 9.08 78.05 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 A 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 A 258 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo 42.33 1.56 26.99 42.38 2.91 28.66 2.66 14.38 76.39 3.95 12.75 76.00 coo 38.45 -0.44 19.89 37.36 0.90 25.90 3.47 17.87 83.94 8.53 16.31 82.03 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 A 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 A 258 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 42.33 1.56 26.99 42.38 2.91 28.66 2.66 14.38 76.39 3.95 12.75 76.00 coo 38.45 -0.44 19.89 37.36 0.90 25.90 3.47 17.87 83.94 8.53 16.31 82.03 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 -7.93 9.11 76.54 -9.19 6.36 75.80 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 B 258 ARG A 102 ARG^? 13.83 O2 AGOL B 114 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 10.15 10.32 71.63 9.22 11.91 72.68 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 15.57 5.57 75.60 11.35 8.72 79.21 coo 2.64 1.83 34.81 1.56 1.13 32.02 16.77 16.26 64.57 17.43 19.14 63.66 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 B 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 B 258 ARG B 3 ARG^? 7.55 O2 GOL A 115 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 10.15 10.32 71.63 9.22 11.91 72.68 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 15.57 5.57 75.60 11.35 8.72 79.21 coo 2.64 1.83 34.81 1.56 1.13 32.02 2.10 9.57 79.57 4.68 9.08 78.05 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 B 2 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 B 258 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 8.17 18.37 77.00 9.28 16.58 76.89 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.47 17.87 83.94 8.53 16.31 82.03 coo 2.64 1.83 34.81 1.56 1.13 32.02 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 B 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 B 258 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 2.66 14.38 76.39 3.95 12.75 76.00 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.47 17.87 83.94 8.53 16.31 82.03 coo 2.64 1.83 34.81 1.56 1.13 32.02 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 B 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 B 258 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 2.66 14.38 76.39 3.95 12.75 76.00 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.47 17.87 83.94 8.53 16.31 82.03 coo 2.64 1.83 34.81 1.56 1.13 32.02 -7.93 9.11 76.54 -9.19 6.36 75.80 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 5 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 C 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 C 258 ARG A 102 ARG^? 13.83 O2 AGOL B 114 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 10.15 10.32 71.63 9.22 11.91 72.68 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 15.57 5.57 75.60 11.35 8.72 79.21 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 16.77 16.26 64.57 17.43 19.14 63.66 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 C 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 C 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 C 258 ARG B 3 ARG^? 7.55 O2 GOL A 115 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 10.15 10.32 71.63 9.22 11.91 72.68 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 15.57 5.57 75.60 11.35 8.72 79.21 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 2.10 9.57 79.57 4.68 9.08 78.05 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 C 2 GLU B 40 GLU^? -5.07 O3 BGOL B 114s C 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 C 258 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 8.17 18.37 77.00 9.28 16.58 76.89 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.47 17.87 83.94 8.53 16.31 82.03 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 C 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 C 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 C 258 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 2.66 14.38 76.39 3.95 12.75 76.00 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.47 17.87 83.94 8.53 16.31 82.03 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 C 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 C 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 C 258 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 2.66 14.38 76.39 3.95 12.75 76.00 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.47 17.87 83.94 8.53 16.31 82.03 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 -7.93 9.11 76.54 -9.19 6.36 75.80 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 5 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 D 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 D 258 ARG A 102 ARG^? 13.83 O2 AGOL B 114 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 10.15 10.32 71.63 9.22 11.91 72.68 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 15.57 5.57 75.60 11.35 8.72 79.21 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 16.77 16.26 64.57 17.43 19.14 63.66 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 D 2 GLU A 66 GLU^? 10.35 O1 GOL A 115 D 56 LYS A 38 LYS^? 8.53 O1 GOL A 115 D 258 ARG B 3 ARG^? 7.55 O2 GOL A 115 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 10.15 10.32 71.63 9.22 11.91 72.68 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 15.57 5.57 75.60 11.35 8.72 79.21 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 2.10 9.57 79.57 4.68 9.08 78.05 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 D 2 GLU B 40 GLU^? -5.07 O3 BGOL B 114s D 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 D 258 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 8.17 18.37 77.00 9.28 16.58 76.89 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.47 17.87 83.94 8.53 16.31 82.03 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 D 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 D 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 D 258 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 2.66 14.38 76.39 3.95 12.75 76.00 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.47 17.87 83.94 8.53 16.31 82.03 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 D 2 GLU B 66 GLU^? 10.26 O3 BGOL B 114 D 56 LYS B 38 LYS^? 6.81 O3 BGOL B 114 D 258 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 2.66 14.38 76.39 3.95 12.75 76.00 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.47 17.87 83.94 8.53 16.31 82.03 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 -7.93 9.11 76.54 -9.19 6.36 75.80 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 5 hits 1k82_c03 naa= 3 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 1 3 # 1 A 290 ARG A 25 ARG~? 12.92 C1 GOL A 115 A 351 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 386 LEU A 24 LEU~? 5.94 O3 GOL A 115 coo 57.36 53.34 128.83 58.45 50.56 128.34 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 60.60 50.64 133.59 60.63 48.82 132.56 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 63.28 54.23 126.45 63.53 52.07 126.70 4.71 -5.33 73.59 4.90 -5.68 75.75 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 2 3 # 2 A 290 ARG B 25 ARG~? 13.22 O1 BGOL B 114 A 351 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 386 LEU B 24 LEU~? 5.58 O1 BGOL B 114 coo 57.36 53.34 128.83 58.45 50.56 128.34 3.18 34.46 77.89 5.47 36.12 76.56 coo 60.60 50.64 133.59 60.63 48.82 132.56 0.85 27.13 76.55 -1.16 26.55 76.75 coo 63.28 54.23 126.45 63.53 52.07 126.70 9.07 29.63 76.10 10.74 29.58 77.49 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 3 3 # 3 A 290 ARG B 25 ARG~? 13.22 O1 BGOL B 114 A 351 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 386 LEU B 24 LEU~? 5.58 O1 BGOL B 114 coo 57.36 53.34 128.83 58.45 50.56 128.34 3.18 34.46 77.89 5.47 36.12 76.56 coo 60.60 50.64 133.59 60.63 48.82 132.56 -1.03 31.78 76.72 0.89 32.00 75.91 coo 63.28 54.23 126.45 63.53 52.07 126.70 9.07 29.63 76.10 10.74 29.58 77.49 1knp_c00 source 1knp L-ASPARTATE OXIDASE : 3 hits 1knp_c00 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 72 ASP~? 17.54 O2 AGOL B 114 262 LYS A 70 LYS.? 17.56 C1 AGOL B 114 336 ARG A 84 ARG~? 10.06 CL CL A 114 coo 61.88 50.78 12.96 63.84 50.60 13.71 26.30 14.43 67.36 25.07 16.12 67.01 coo 63.59 44.40 18.32 63.20 49.74 17.95 22.34 11.58 74.38 24.39 10.91 80.02 coo 72.60 57.42 15.86 71.61 56.68 18.70 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP B 72 ASP~? 17.82 O3 GOL A 115 262 LYS B 70 LYS.? 19.75 O3 BGOL B 114 336 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 61.88 50.78 12.96 63.84 50.60 13.71 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 63.59 44.40 18.32 63.20 49.74 17.95 -1.97 11.40 87.62 0.73 12.09 92.99 coo 72.60 57.42 15.86 71.61 56.68 18.70 -8.32 22.59 81.65 -10.97 23.53 80.37 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 2 hits 1lam_c00 naa= 3 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 1 3 # 1 A 44 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 45 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 261 PHE B 19 PHE~? 11.52 O2 BGOL B 114 coo 49.89 1.93 30.83 50.54 1.43 32.81 -1.03 31.78 76.72 0.89 32.00 75.91 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 0.85 27.13 76.55 -1.16 26.55 76.75 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 4.89 28.90 67.24 3.84 26.39 67.76 1luc_c00 source 1luc BACTERIAL LUCIFERASE : 1 hits 1luc_c00 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 16 ASP~? 16.03 O2 GOL A 115 A 265 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 369 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 11.74 38.14 80.19 10.63 36.40 80.65 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 17.36 23.57 72.04 18.68 21.92 71.98 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 12.19 31.08 87.29 11.13 32.66 86.38 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 265 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 369 ASP A 16 ASP~? 16.03 O2 GOL A 115 coo 11.74 38.14 80.19 10.63 36.40 80.65 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 17.36 23.57 72.04 18.68 21.92 71.98 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 12.19 31.08 87.29 11.13 32.66 86.38 -6.36 -4.07 67.12 -7.21 -2.58 65.89 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c05 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 20 ARG~? 7.91 O3 GOL A 115 229 SER A 15 SER~? 16.97 O3 GOL A 115 325 GLU A 17 GLU~? 11.95 O3 GOL A 115 coo 2.54 15.84 18.57 3.24 17.85 16.30 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo 10.17 13.48 15.92 9.61 15.76 15.27 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 5.42 13.04 19.75 5.74 13.81 17.79 -5.33 -8.56 70.68 -3.96 -7.90 72.21 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 2 3 # 2 159 ARG A 25 ARG~? 12.92 C1 GOL A 115 229 SER A 30 SER~? 7.32 O1 GOL A 115 325 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo 2.54 15.84 18.57 3.24 17.85 16.30 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 10.17 13.48 15.92 9.61 15.76 15.27 15.10 -1.32 71.94 13.61 -0.13 73.45 coo 5.42 13.04 19.75 5.74 13.81 17.79 9.84 -6.23 75.42 9.01 -8.17 75.63 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 2 hits 1mbb_c00 naa= 3 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 3 # 1 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 35 SER A 15 SER~? 16.97 O3 GOL A 115 215 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 20.97 14.47 32.28 19.66 15.96 31.62 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 16.04 14.72 33.82 17.27 13.71 31.95 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 20.65 22.00 33.80 20.06 20.56 32.39 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 2 3 # 2 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 35 SER B 15 SER~? 17.11 O1 AGOL B 114 215 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 20.97 14.47 32.28 19.66 15.96 31.62 9.86 30.83 63.58 9.25 29.72 61.91 coo 16.04 14.72 33.82 17.27 13.71 31.95 6.70 34.48 63.20 7.42 36.00 64.96 coo 20.65 22.00 33.80 20.06 20.56 32.39 4.69 24.83 64.29 4.38 25.55 62.31 1mpp_c04 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 2 hits 1mpp_c04 naa= 3 ULMN 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 A 199 HIS A 37 HIS.? 13.87 O1 GOL A 115 A 246 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 255 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 93.73 21.39 -6.05 92.24 22.72 -5.44 19.30 8.07 76.97 19.38 8.41 79.04 coo 85.83 25.80 -8.70 86.18 27.15 -7.14 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 84.84 30.41 -2.58 86.81 29.07 -4.09 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 A 199 HIS B 37 HIS.? 13.44 O3 BGOL B 114 A 246 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 255 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 93.73 21.39 -6.05 92.24 22.72 -5.44 2.31 14.88 87.33 4.16 14.09 87.92 coo 85.83 25.80 -8.70 86.18 27.15 -7.14 5.80 25.06 85.89 7.38 24.42 84.67 coo 84.84 30.41 -2.58 86.81 29.07 -4.09 7.36 24.77 79.77 8.81 23.32 81.62 1mpy_c00 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c00 naa= 3 ULMN 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 B 199 HIS A 37 HIS.? 13.87 O1 GOL A 115 B 246 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 255 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 53.99 30.51 -6.27 55.94 30.59 -7.04 19.30 8.07 76.97 19.38 8.41 79.04 coo 63.25 31.40 -4.63 63.50 32.04 -6.62 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 65.74 33.16 -11.89 63.54 33.33 -10.19 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 B 199 HIS B 37 HIS.? 13.44 O3 BGOL B 114 B 246 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 255 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 53.99 30.51 -6.27 55.94 30.59 -7.04 2.31 14.88 87.33 4.16 14.09 87.92 coo 63.25 31.40 -4.63 63.50 32.04 -6.62 5.80 25.06 85.89 7.38 24.42 84.67 coo 65.74 33.16 -11.89 63.54 33.33 -10.19 7.36 24.77 79.77 8.81 23.32 81.62 1mpy_c01 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c01 naa= 3 ULMN 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 C 199 HIS A 37 HIS.? 13.87 O1 GOL A 115 C 246 HIS A 31 HIS~? 8.53 C1 GOL A 115 C 255 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 88.23 -2.44 -2.31 86.28 -2.49 -3.06 19.30 8.07 76.97 19.38 8.41 79.04 coo 79.18 -3.01 0.51 78.86 -4.28 -1.13 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 76.37 -6.84 -5.95 78.54 -6.39 -4.23 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 C 199 HIS B 37 HIS.? 13.44 O3 BGOL B 114 C 246 HIS B 31 HIS~? 8.39 O3 AGOL B 114 C 255 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 88.23 -2.44 -2.31 86.28 -2.49 -3.06 2.31 14.88 87.33 4.16 14.09 87.92 coo 79.18 -3.01 0.51 78.86 -4.28 -1.13 5.80 25.06 85.89 7.38 24.42 84.67 coo 76.37 -6.84 -5.95 78.54 -6.39 -4.23 7.36 24.77 79.77 8.81 23.32 81.62 1mpy_c02 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c02 naa= 3 ULMN 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 D 199 HIS A 37 HIS.? 13.87 O1 GOL A 115 D 246 HIS A 31 HIS~? 8.53 C1 GOL A 115 D 255 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 48.45 6.59 -2.19 50.13 5.63 -1.41 19.30 8.07 76.97 19.38 8.41 79.04 coo 56.33 1.43 -3.93 56.30 0.87 -1.91 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 57.78 -0.98 3.43 55.81 -0.18 1.59 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 D 199 HIS B 37 HIS.? 13.44 O3 BGOL B 114 D 246 HIS B 31 HIS~? 8.39 O3 AGOL B 114 D 255 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 48.45 6.59 -2.19 50.13 5.63 -1.41 2.31 14.88 87.33 4.16 14.09 87.92 coo 56.33 1.43 -3.93 56.30 0.87 -1.91 5.80 25.06 85.89 7.38 24.42 84.67 coo 57.78 -0.98 3.43 55.81 -0.18 1.59 7.36 24.77 79.77 8.81 23.32 81.62 1mpy_c03 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c03 naa= 3 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 # 1 A 465 GLY A 0 GLY.? 9.99 C1 AGOL B 114 A 501 ASP A 32 ASP.? 10.78 CL CL A 114 B 367 TYR B 78 TYR~? 15.72 O3 AGOL B 114 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 20.76 18.47 75.10 20.41 17.78 75.41 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 -6.72 19.79 83.49 -5.56 20.39 81.01 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 # 2 A 465 GLY A 96 GLY.? 15.65 O1 GOL A 115 A 501 ASP A 82 ASP~? -5.90 CL CL A 114s B 367 TYR B 39 TYR^? 6.45 O3 AGOL B 114 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 4.70 0.89 60.28 5.25 0.94 60.81 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 24.56 -4.97 62.32 26.00 -4.59 60.80 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 2.56 21.42 79.08 2.05 22.43 76.53 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 # 3 A 465 GLY A 108 GLY.? 6.91 O1 AGOL B 114 A 501 ASP B 32 ASP.? 14.27 O1 BGOL B 114 B 367 TYR A 78 TYR~? 10.44 CL CL A 114 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 17.31 29.05 74.33 17.01 28.36 74.18 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 0.49 28.13 88.01 2.42 28.83 88.55 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 20.68 4.89 66.65 17.95 4.78 66.23 1mro_c00 source 1mro METHYL-COENZYME M REDUCTASE : 3 hits 1mro_c00 naa= 3 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 # 1 D 465 GLY A 0 GLY.? 9.99 C1 AGOL B 114 D 501 ASP A 32 ASP.? 10.78 CL CL A 114 E 367 TYR B 78 TYR~? 15.72 O3 AGOL B 114 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 20.76 18.47 75.10 20.41 17.78 75.41 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 -6.72 19.79 83.49 -5.56 20.39 81.01 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 # 2 D 465 GLY A 96 GLY.? 15.65 O1 GOL A 115 D 501 ASP A 82 ASP~? -5.90 CL CL A 114s E 367 TYR B 39 TYR^? 6.45 O3 AGOL B 114 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 4.70 0.89 60.28 5.25 0.94 60.81 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 24.56 -4.97 62.32 26.00 -4.59 60.80 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 2.56 21.42 79.08 2.05 22.43 76.53 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 # 3 D 465 GLY A 108 GLY.? 6.91 O1 AGOL B 114 D 501 ASP B 32 ASP.? 14.27 O1 BGOL B 114 E 367 TYR A 78 TYR~? 10.44 CL CL A 114 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 17.31 29.05 74.33 17.01 28.36 74.18 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 0.49 28.13 88.01 2.42 28.83 88.55 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 20.68 4.89 66.65 17.95 4.78 66.23 1mro_c01 source 1mro METHYL-COENZYME M REDUCTASE : 3 hits 1mro_c01 naa= 3 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 1 3 # 1 A 50 ASP A 72 ASP~? 17.54 O2 AGOL B 114 A 55 TYR A 75 TYR~? 14.24 CL CL A 114 A 84 LYS A 70 LYS.? 17.56 C1 AGOL B 114 coo 11.09 42.89 24.44 11.32 42.06 22.49 26.30 14.43 67.36 25.07 16.12 67.01 coo 4.60 40.33 20.42 7.25 39.50 20.05 21.81 10.09 65.59 20.00 9.75 63.52 coo 9.71 44.83 15.47 10.13 41.43 19.93 22.34 11.58 74.38 24.39 10.91 80.02 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 2 3 # 2 A 50 ASP B 72 ASP~? 17.82 O3 GOL A 115 A 55 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 84 LYS B 70 LYS.? 19.75 O3 BGOL B 114 coo 11.09 42.89 24.44 11.32 42.06 22.49 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 4.60 40.33 20.42 7.25 39.50 20.05 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 9.71 44.83 15.47 10.13 41.43 19.93 -1.97 11.40 87.62 0.73 12.09 92.99 1mrq_c02 source 1mrq ALDO-KETO REDUCTASE FAMILY 1 MEMBER C1 : 2 hits 1mrq_c02 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 60 HIS.? 17.72 O2 GOL A 115 A 197 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 223 ALA B 104 ALA^? 7.64 O2 GOL A 115 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 -6.29 5.83 61.74 -6.55 4.46 63.31 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 -2.07 4.32 76.12 -3.28 3.38 75.81 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 A 114 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 197 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 223 ALA A 104 ALA^? 7.60 O2 AGOL B 114 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 4.96 22.92 58.66 6.72 23.67 59.53 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 4.69 24.83 64.29 4.38 25.55 62.31 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 13.87 20.71 69.74 14.50 21.78 68.82 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 2 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 60 HIS.? 17.72 O2 GOL A 115 B 197 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 223 ALA B 104 ALA^? 7.64 O2 GOL A 115 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 -6.29 5.83 61.74 -6.55 4.46 63.31 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 -2.07 4.32 76.12 -3.28 3.38 75.81 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 B 114 HIS B 60 HIS.? 17.24 O2 AGOL B 114 B 197 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 223 ALA A 104 ALA^? 7.60 O2 AGOL B 114 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 4.96 22.92 58.66 6.72 23.67 59.53 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 4.69 24.83 64.29 4.38 25.55 62.31 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 13.87 20.71 69.74 14.50 21.78 68.82 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 2 hits 1n2t_c03 naa= 3 ULMN 3 1nhx_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE, Cuser 1 3 # 1 A 264 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 290 LYS A 38 LYS^? 8.53 O1 GOL A 115 A 405 ARG A 42 ARG^? 5.53 O2 GOL A 115 coo 41.33 25.99 28.05 41.95 26.95 29.80 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 37.11 33.75 31.82 38.72 27.95 29.90 15.57 5.57 75.60 11.35 8.72 79.21 coo 42.28 27.98 41.30 43.16 28.14 38.35 2.91 6.62 75.93 0.97 5.83 78.22 ULMN 3 1nhx_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE, Cuser 2 3 # 2 A 264 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 290 LYS A 38 LYS^? 8.53 O1 GOL A 115 A 405 ARG A 84 ARG~? 10.06 CL CL A 114 coo 41.33 25.99 28.05 41.95 26.95 29.80 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 37.11 33.75 31.82 38.72 27.95 29.90 15.57 5.57 75.60 11.35 8.72 79.21 coo 42.28 27.98 41.30 43.16 28.14 38.35 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1nhx_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE, Cuser 3 3 # 3 A 264 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 290 LYS B 92 LYS~? 22.65 O3 AGOL B 114 A 405 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 41.33 25.99 28.05 41.95 26.95 29.80 0.85 27.13 76.55 -1.16 26.55 76.75 coo 37.11 33.75 31.82 38.72 27.95 29.90 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 42.28 27.98 41.30 43.16 28.14 38.35 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1nhx_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE, Cuser 4 3 # 4 A 264 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 290 LYS B 38 LYS^? 6.81 O3 BGOL B 114 A 405 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 41.33 25.99 28.05 41.95 26.95 29.80 5.80 25.06 85.89 7.38 24.42 84.67 coo 37.11 33.75 31.82 38.72 27.95 29.90 3.47 17.87 83.94 8.53 16.31 82.03 coo 42.28 27.98 41.30 43.16 28.14 38.35 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1nhx_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE, Cuser 5 3 # 5 A 264 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 290 LYS B 10 LYS.? 17.18 O2 BGOL B 114 A 405 ARG B 20 ARG~? 7.55 O1 AGOL B 114 coo 41.33 25.99 28.05 41.95 26.95 29.80 4.96 22.92 58.66 6.72 23.67 59.53 coo 37.11 33.75 31.82 38.72 27.95 29.90 1.10 28.15 64.50 5.88 30.75 61.34 coo 42.28 27.98 41.30 43.16 28.14 38.35 12.50 29.25 70.09 15.28 27.90 70.29 1nhx_c00 source 1nhx PHOSPHOENOLPYRUVATE CARBOXYKINASE, CYTOSOLIC : 5 hits 1nhx_c00 naa= 3 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 B 59 GLU A 40 GLU^? -5.26 O1 GOL A 115s B 128 HIS A 31 HIS~? 8.53 C1 GOL A 115 C 263 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 6.12 5.94 82.00 7.16 6.32 83.81 7.17 5.83 75.53 6.75 7.34 76.93 coo 12.51 16.35 80.99 13.16 14.90 82.37 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 11.58 14.94 93.26 12.25 14.03 91.50 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 B 59 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 128 HIS A 26 HIS~? 10.00 O1 GOL A 115 C 263 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 6.12 5.94 82.00 7.16 6.32 83.81 10.15 10.32 71.63 9.22 11.91 72.68 coo 12.51 16.35 80.99 13.16 14.90 82.37 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 11.58 14.94 93.26 12.25 14.03 91.50 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 3 3 # 3 B 59 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 128 HIS A 37 HIS.? 13.87 O1 GOL A 115 C 263 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 6.12 5.94 82.00 7.16 6.32 83.81 10.15 10.32 71.63 9.22 11.91 72.68 coo 12.51 16.35 80.99 13.16 14.90 82.37 19.30 8.07 76.97 19.38 8.41 79.04 coo 11.58 14.94 93.26 12.25 14.03 91.50 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 4 3 # 4 B 59 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B 128 HIS B 31 HIS~? 8.39 O3 AGOL B 114 C 263 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 6.12 5.94 82.00 7.16 6.32 83.81 8.17 18.37 77.00 9.28 16.58 76.89 coo 12.51 16.35 80.99 13.16 14.90 82.37 5.80 25.06 85.89 7.38 24.42 84.67 coo 11.58 14.94 93.26 12.25 14.03 91.50 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 5 3 # 5 B 59 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 128 HIS B 26 HIS~? 10.11 O3 AGOL B 114 C 263 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 6.12 5.94 82.00 7.16 6.32 83.81 2.66 14.38 76.39 3.95 12.75 76.00 coo 12.51 16.35 80.99 13.16 14.90 82.37 0.85 27.13 76.55 -1.16 26.55 76.75 coo 11.58 14.94 93.26 12.25 14.03 91.50 5.80 25.06 85.89 7.38 24.42 84.67 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 6 3 # 6 B 59 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 128 HIS B 37 HIS.? 13.44 O3 BGOL B 114 C 263 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 6.12 5.94 82.00 7.16 6.32 83.81 2.66 14.38 76.39 3.95 12.75 76.00 coo 12.51 16.35 80.99 13.16 14.90 82.37 2.31 14.88 87.33 4.16 14.09 87.92 coo 11.58 14.94 93.26 12.25 14.03 91.50 5.80 25.06 85.89 7.38 24.42 84.67 1ni4_c00 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 6 hits 1ni4_c00 naa= 3 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 A 263 HIS A 31 HIS~? 8.53 C1 GOL A 115 D 59 GLU A 66 GLU^? 10.35 O1 GOL A 115 D 128 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 10.15 10.32 71.63 9.22 11.91 72.68 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 A 263 HIS A 31 HIS~? 8.53 C1 GOL A 115 D 59 GLU A 66 GLU^? 10.35 O1 GOL A 115 D 128 HIS A 37 HIS.? 13.87 O1 GOL A 115 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 10.15 10.32 71.63 9.22 11.91 72.68 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 19.30 8.07 76.97 19.38 8.41 79.04 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 3 3 # 3 A 263 HIS A 90 HIS~? 13.16 C1 GOL A 115 D 59 GLU A 40 GLU^? -5.26 O1 GOL A 115s D 128 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 7.17 5.83 75.53 6.75 7.34 76.93 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 4 3 # 4 A 263 HIS B 31 HIS~? 8.39 O3 AGOL B 114 D 59 GLU B 66 GLU^? 10.26 O3 BGOL B 114 D 128 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 5.80 25.06 85.89 7.38 24.42 84.67 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 2.66 14.38 76.39 3.95 12.75 76.00 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 5 3 # 5 A 263 HIS B 31 HIS~? 8.39 O3 AGOL B 114 D 59 GLU B 66 GLU^? 10.26 O3 BGOL B 114 D 128 HIS B 37 HIS.? 13.44 O3 BGOL B 114 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 5.80 25.06 85.89 7.38 24.42 84.67 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 2.66 14.38 76.39 3.95 12.75 76.00 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 2.31 14.88 87.33 4.16 14.09 87.92 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 6 3 # 6 A 263 HIS B 90 HIS~? 13.22 O3 AGOL B 114 D 59 GLU B 40 GLU^? -5.07 O3 BGOL B 114s D 128 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 -1.03 31.78 76.72 0.89 32.00 75.91 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 8.17 18.37 77.00 9.28 16.58 76.89 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 5.80 25.06 85.89 7.38 24.42 84.67 1ni4_c01 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 6 hits 1ni4_c01 naa= 3 ULMN 3 1nsf_c00 N-ETHYLMALEIMIDE SENSITIVE FACTOR user 1 3 # 1 549 LYS A 99 LYS.? 18.44 CL CL A 114 631 LYS B 10 LYS.? 17.18 O2 BGOL B 114 708 LYS A 92 LYS~? 15.91 CL CL A 114 coo 8.61 33.06 11.15 10.12 29.19 8.82 10.32 8.81 58.96 14.77 8.28 57.43 coo -11.99 27.40 17.14 -13.60 24.52 11.71 1.10 28.15 64.50 5.88 30.75 61.34 coo 18.16 32.86 9.85 16.06 28.20 13.56 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1nsf_c00 N-ETHYLMALEIMIDE SENSITIVE FACTOR user 2 3 # 2 549 LYS B 10 LYS.? 17.18 O2 BGOL B 114 631 LYS A 99 LYS.? 18.44 CL CL A 114 708 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 8.61 33.06 11.15 10.12 29.19 8.82 1.10 28.15 64.50 5.88 30.75 61.34 coo -11.99 27.40 17.14 -13.60 24.52 11.71 10.32 8.81 58.96 14.77 8.28 57.43 coo 18.16 32.86 9.85 16.06 28.20 13.56 -5.61 30.35 71.49 -11.81 30.46 73.02 1nsf_c00 source 1nsf N-ETHYLMALEIMIDE SENSITIVE FACTOR : 2 hits 1nsf_c00 naa= 3 ULMN 3 1ofd_c02 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 1 3 # 1 A 1 CYH B 67 CYH^? 10.77 O3 AGOL B 114 A 903 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 972 LYS A 92 LYS~? 15.91 CL CL A 114 coo 88.42 112.53 24.94 87.72 110.88 27.11 0.03 16.72 79.11 -1.50 18.92 78.46 coo 61.58 117.15 13.99 62.31 115.51 15.12 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 60.18 107.64 21.53 58.13 110.55 17.14 9.32 -0.83 59.34 13.60 2.28 58.11 1ofd_c02 source 1ofd FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE 2 : 1 hits 1ofd_c02 naa= 3 ULMN 3 1ofd_c03 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 1 3 # 1 B 1 CYH B 67 CYH^? 10.77 O3 AGOL B 114 B 903 GLU A 22 GLU~? 14.62 C1 GOL A 115 B 972 LYS A 92 LYS~? 15.91 CL CL A 114 coo 31.47 38.87 24.90 30.94 36.98 26.93 0.03 16.72 79.11 -1.50 18.92 78.46 coo 4.13 40.53 14.21 5.06 38.89 15.19 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 4.08 30.40 21.12 1.62 33.28 16.83 9.32 -0.83 59.34 13.60 2.28 58.11 1ofd_c03 source 1ofd FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE 2 : 1 hits 1ofd_c03 naa= 3 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 A 175 LYS A 10 LYS.? 17.78 O2 GOL A 115 A 208 GLN A 97 GLN.? 13.57 O1 GOL A 115 A 209 LYS A 99 LYS.? 18.44 CL CL A 114 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 10.06 3.47 61.87 11.73 2.73 62.95 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 10.32 8.81 58.96 14.77 8.28 57.43 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 A 175 LYS A 85 LYS~? 9.11 CL CL A 114 A 208 GLN A 97 GLN.? 13.57 O1 GOL A 115 A 209 LYS A 99 LYS.? 18.44 CL CL A 114 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 19.43 -1.95 61.52 24.42 -0.23 58.09 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 10.06 3.47 61.87 11.73 2.73 62.95 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 10.32 8.81 58.96 14.77 8.28 57.43 1ohh_c06 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 2 hits 1ohh_c06 naa= 3 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 B 175 LYS A 10 LYS.? 17.78 O2 GOL A 115 B 208 GLN A 97 GLN.? 13.57 O1 GOL A 115 B 209 LYS A 99 LYS.? 18.44 CL CL A 114 coo 105.03 46.01 19.55 106.59 42.35 15.55 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo 113.93 46.99 13.56 113.37 48.52 14.95 10.06 3.47 61.87 11.73 2.73 62.95 coo 115.66 49.12 8.60 111.19 49.52 4.73 10.32 8.81 58.96 14.77 8.28 57.43 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 B 175 LYS A 85 LYS~? 9.11 CL CL A 114 B 208 GLN A 97 GLN.? 13.57 O1 GOL A 115 B 209 LYS A 99 LYS.? 18.44 CL CL A 114 coo 105.03 46.01 19.55 106.59 42.35 15.55 19.43 -1.95 61.52 24.42 -0.23 58.09 coo 113.93 46.99 13.56 113.37 48.52 14.95 10.06 3.47 61.87 11.73 2.73 62.95 coo 115.66 49.12 8.60 111.19 49.52 4.73 10.32 8.81 58.96 14.77 8.28 57.43 1ohh_c07 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 2 hits 1ohh_c07 naa= 3 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 C 175 LYS A 10 LYS.? 17.78 O2 GOL A 115 C 208 GLN A 97 GLN.? 13.57 O1 GOL A 115 C 209 LYS A 99 LYS.? 18.44 CL CL A 114 coo 100.54 -2.78 25.52 103.29 2.02 24.05 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 10.06 3.47 61.87 11.73 2.73 62.95 coo 113.62 1.19 33.65 109.52 3.92 36.47 10.32 8.81 58.96 14.77 8.28 57.43 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 C 175 LYS A 85 LYS~? 9.11 CL CL A 114 C 208 GLN A 97 GLN.? 13.57 O1 GOL A 115 C 209 LYS A 99 LYS.? 18.44 CL CL A 114 coo 100.54 -2.78 25.52 103.29 2.02 24.05 19.43 -1.95 61.52 24.42 -0.23 58.09 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 10.06 3.47 61.87 11.73 2.73 62.95 coo 113.62 1.19 33.65 109.52 3.92 36.47 10.32 8.81 58.96 14.77 8.28 57.43 1ohh_c08 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 2 hits 1ohh_c08 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 32 ASP.? 10.78 CL CL A 114 A 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s A 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -3.50 124.89 25.05 -2.25 124.77 23.26 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 1.87 119.38 16.45 1.41 122.11 16.84 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -2.59 124.07 12.67 -0.91 126.17 18.42 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 A 24 ASP A 32 ASP.? 10.78 CL CL A 114 A 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -3.50 124.89 25.05 -2.25 124.77 23.26 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 1.87 119.38 16.45 1.41 122.11 16.84 11.79 2.97 71.53 9.83 2.65 69.55 coo -2.59 124.07 12.67 -0.91 126.17 18.42 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 A 24 ASP A 32 ASP.? 10.78 CL CL A 114 A 146 TYR A 78 TYR~? 10.44 CL CL A 114 A 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -3.50 124.89 25.05 -2.25 124.77 23.26 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 1.87 119.38 16.45 1.41 122.11 16.84 20.68 4.89 66.65 17.95 4.78 66.23 coo -2.59 124.07 12.67 -0.91 126.17 18.42 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 A 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 A 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -3.50 124.89 25.05 -2.25 124.77 23.26 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 1.87 119.38 16.45 1.41 122.11 16.84 9.35 7.19 64.40 12.10 6.95 63.91 coo -2.59 124.07 12.67 -0.91 126.17 18.42 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 A 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s A 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -3.50 124.89 25.05 -2.25 124.77 23.26 0.49 28.13 88.01 2.42 28.83 88.55 coo 1.87 119.38 16.45 1.41 122.11 16.84 7.36 24.77 79.77 8.81 23.32 81.62 coo -2.59 124.07 12.67 -0.91 126.17 18.42 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 A 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -3.50 124.89 25.05 -2.25 124.77 23.26 0.49 28.13 88.01 2.42 28.83 88.55 coo 1.87 119.38 16.45 1.41 122.11 16.84 2.56 21.42 79.08 2.05 22.43 76.53 coo -2.59 124.07 12.67 -0.91 126.17 18.42 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 A 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 A 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -3.50 124.89 25.05 -2.25 124.77 23.26 0.49 28.13 88.01 2.42 28.83 88.55 coo 1.87 119.38 16.45 1.41 122.11 16.84 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -2.59 124.07 12.67 -0.91 126.17 18.42 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 A 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 A 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -3.50 124.89 25.05 -2.25 124.77 23.26 4.69 24.83 64.29 4.38 25.55 62.31 coo 1.87 119.38 16.45 1.41 122.11 16.84 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -2.59 124.07 12.67 -0.91 126.17 18.42 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c00 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c00 naa= 3 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 B 24 ASP A 32 ASP.? 10.78 CL CL A 114 B 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s B 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -7.43 109.06 51.23 -5.84 110.54 50.86 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 0.22 114.56 44.62 -0.76 115.18 47.18 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -4.18 120.17 46.85 -4.02 115.31 51.00 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 B 24 ASP A 32 ASP.? 10.78 CL CL A 114 B 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -7.43 109.06 51.23 -5.84 110.54 50.86 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 0.22 114.56 44.62 -0.76 115.18 47.18 11.79 2.97 71.53 9.83 2.65 69.55 coo -4.18 120.17 46.85 -4.02 115.31 51.00 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 B 24 ASP A 32 ASP.? 10.78 CL CL A 114 B 146 TYR A 78 TYR~? 10.44 CL CL A 114 B 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -7.43 109.06 51.23 -5.84 110.54 50.86 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 0.22 114.56 44.62 -0.76 115.18 47.18 20.68 4.89 66.65 17.95 4.78 66.23 coo -4.18 120.17 46.85 -4.02 115.31 51.00 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 B 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 B 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -7.43 109.06 51.23 -5.84 110.54 50.86 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 0.22 114.56 44.62 -0.76 115.18 47.18 9.35 7.19 64.40 12.10 6.95 63.91 coo -4.18 120.17 46.85 -4.02 115.31 51.00 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 B 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 B 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s B 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -7.43 109.06 51.23 -5.84 110.54 50.86 0.49 28.13 88.01 2.42 28.83 88.55 coo 0.22 114.56 44.62 -0.76 115.18 47.18 7.36 24.77 79.77 8.81 23.32 81.62 coo -4.18 120.17 46.85 -4.02 115.31 51.00 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 B 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 B 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -7.43 109.06 51.23 -5.84 110.54 50.86 0.49 28.13 88.01 2.42 28.83 88.55 coo 0.22 114.56 44.62 -0.76 115.18 47.18 2.56 21.42 79.08 2.05 22.43 76.53 coo -4.18 120.17 46.85 -4.02 115.31 51.00 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 B 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 B 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 B 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -7.43 109.06 51.23 -5.84 110.54 50.86 0.49 28.13 88.01 2.42 28.83 88.55 coo 0.22 114.56 44.62 -0.76 115.18 47.18 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -4.18 120.17 46.85 -4.02 115.31 51.00 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 B 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 B 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -7.43 109.06 51.23 -5.84 110.54 50.86 4.69 24.83 64.29 4.38 25.55 62.31 coo 0.22 114.56 44.62 -0.76 115.18 47.18 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -4.18 120.17 46.85 -4.02 115.31 51.00 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c01 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c01 naa= 3 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 C 24 ASP A 32 ASP.? 10.78 CL CL A 114 C 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s C 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -13.49 79.65 43.90 -12.13 80.29 45.45 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -5.65 86.78 48.49 -7.16 84.72 49.65 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -11.22 87.18 53.49 -10.94 81.64 50.31 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 C 24 ASP A 32 ASP.? 10.78 CL CL A 114 C 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 C 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -13.49 79.65 43.90 -12.13 80.29 45.45 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -5.65 86.78 48.49 -7.16 84.72 49.65 11.79 2.97 71.53 9.83 2.65 69.55 coo -11.22 87.18 53.49 -10.94 81.64 50.31 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 C 24 ASP A 32 ASP.? 10.78 CL CL A 114 C 146 TYR A 78 TYR~? 10.44 CL CL A 114 C 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -13.49 79.65 43.90 -12.13 80.29 45.45 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -5.65 86.78 48.49 -7.16 84.72 49.65 20.68 4.89 66.65 17.95 4.78 66.23 coo -11.22 87.18 53.49 -10.94 81.64 50.31 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 C 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 C 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 C 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -13.49 79.65 43.90 -12.13 80.29 45.45 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -5.65 86.78 48.49 -7.16 84.72 49.65 9.35 7.19 64.40 12.10 6.95 63.91 coo -11.22 87.18 53.49 -10.94 81.64 50.31 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 C 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 C 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s C 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -13.49 79.65 43.90 -12.13 80.29 45.45 0.49 28.13 88.01 2.42 28.83 88.55 coo -5.65 86.78 48.49 -7.16 84.72 49.65 7.36 24.77 79.77 8.81 23.32 81.62 coo -11.22 87.18 53.49 -10.94 81.64 50.31 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 C 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 C 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 C 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -13.49 79.65 43.90 -12.13 80.29 45.45 0.49 28.13 88.01 2.42 28.83 88.55 coo -5.65 86.78 48.49 -7.16 84.72 49.65 2.56 21.42 79.08 2.05 22.43 76.53 coo -11.22 87.18 53.49 -10.94 81.64 50.31 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 C 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 C 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 C 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -13.49 79.65 43.90 -12.13 80.29 45.45 0.49 28.13 88.01 2.42 28.83 88.55 coo -5.65 86.78 48.49 -7.16 84.72 49.65 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -11.22 87.18 53.49 -10.94 81.64 50.31 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 C 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 C 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -13.49 79.65 43.90 -12.13 80.29 45.45 4.69 24.83 64.29 4.38 25.55 62.31 coo -5.65 86.78 48.49 -7.16 84.72 49.65 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -11.22 87.18 53.49 -10.94 81.64 50.31 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c02 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c02 naa= 3 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 D 24 ASP A 32 ASP.? 10.78 CL CL A 114 D 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s D 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -13.44 77.36 13.12 -12.53 75.97 14.48 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -7.85 74.44 22.75 -9.22 72.86 20.89 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -14.24 70.61 23.48 -12.55 71.73 17.42 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 D 24 ASP A 32 ASP.? 10.78 CL CL A 114 D 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 D 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -13.44 77.36 13.12 -12.53 75.97 14.48 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -7.85 74.44 22.75 -9.22 72.86 20.89 11.79 2.97 71.53 9.83 2.65 69.55 coo -14.24 70.61 23.48 -12.55 71.73 17.42 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 D 24 ASP A 32 ASP.? 10.78 CL CL A 114 D 146 TYR A 78 TYR~? 10.44 CL CL A 114 D 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -13.44 77.36 13.12 -12.53 75.97 14.48 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -7.85 74.44 22.75 -9.22 72.86 20.89 20.68 4.89 66.65 17.95 4.78 66.23 coo -14.24 70.61 23.48 -12.55 71.73 17.42 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 D 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 D 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 D 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -13.44 77.36 13.12 -12.53 75.97 14.48 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -7.85 74.44 22.75 -9.22 72.86 20.89 9.35 7.19 64.40 12.10 6.95 63.91 coo -14.24 70.61 23.48 -12.55 71.73 17.42 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 D 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 D 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s D 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -13.44 77.36 13.12 -12.53 75.97 14.48 0.49 28.13 88.01 2.42 28.83 88.55 coo -7.85 74.44 22.75 -9.22 72.86 20.89 7.36 24.77 79.77 8.81 23.32 81.62 coo -14.24 70.61 23.48 -12.55 71.73 17.42 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 D 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 D 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 D 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -13.44 77.36 13.12 -12.53 75.97 14.48 0.49 28.13 88.01 2.42 28.83 88.55 coo -7.85 74.44 22.75 -9.22 72.86 20.89 2.56 21.42 79.08 2.05 22.43 76.53 coo -14.24 70.61 23.48 -12.55 71.73 17.42 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 D 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 D 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 D 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -13.44 77.36 13.12 -12.53 75.97 14.48 0.49 28.13 88.01 2.42 28.83 88.55 coo -7.85 74.44 22.75 -9.22 72.86 20.89 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -14.24 70.61 23.48 -12.55 71.73 17.42 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 D 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 D 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 D 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -13.44 77.36 13.12 -12.53 75.97 14.48 4.69 24.83 64.29 4.38 25.55 62.31 coo -7.85 74.44 22.75 -9.22 72.86 20.89 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -14.24 70.61 23.48 -12.55 71.73 17.42 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c03 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c03 naa= 3 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 E 24 ASP A 32 ASP.? 10.78 CL CL A 114 E 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s E 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -7.12 105.25 1.43 -6.30 103.34 0.77 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -3.11 94.55 3.01 -3.83 95.92 0.66 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 E 24 ASP A 32 ASP.? 10.78 CL CL A 114 E 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 E 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -7.12 105.25 1.43 -6.30 103.34 0.77 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -3.11 94.55 3.01 -3.83 95.92 0.66 11.79 2.97 71.53 9.83 2.65 69.55 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 E 24 ASP A 32 ASP.? 10.78 CL CL A 114 E 146 TYR A 78 TYR~? 10.44 CL CL A 114 E 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -7.12 105.25 1.43 -6.30 103.34 0.77 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -3.11 94.55 3.01 -3.83 95.92 0.66 20.68 4.89 66.65 17.95 4.78 66.23 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 E 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 E 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 E 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -7.12 105.25 1.43 -6.30 103.34 0.77 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -3.11 94.55 3.01 -3.83 95.92 0.66 9.35 7.19 64.40 12.10 6.95 63.91 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 E 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 E 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s E 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -7.12 105.25 1.43 -6.30 103.34 0.77 0.49 28.13 88.01 2.42 28.83 88.55 coo -3.11 94.55 3.01 -3.83 95.92 0.66 7.36 24.77 79.77 8.81 23.32 81.62 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 E 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 E 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 E 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -7.12 105.25 1.43 -6.30 103.34 0.77 0.49 28.13 88.01 2.42 28.83 88.55 coo -3.11 94.55 3.01 -3.83 95.92 0.66 2.56 21.42 79.08 2.05 22.43 76.53 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 E 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 E 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 E 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -7.12 105.25 1.43 -6.30 103.34 0.77 0.49 28.13 88.01 2.42 28.83 88.55 coo -3.11 94.55 3.01 -3.83 95.92 0.66 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 E 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 E 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 E 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -7.12 105.25 1.43 -6.30 103.34 0.77 4.69 24.83 64.29 4.38 25.55 62.31 coo -3.11 94.55 3.01 -3.83 95.92 0.66 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c04 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c04 naa= 3 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 F 24 ASP A 32 ASP.? 10.78 CL CL A 114 F 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s F 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -44.75 128.15 10.28 -45.68 129.67 11.55 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -50.43 131.90 19.60 -49.04 133.31 17.60 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -44.10 135.86 19.99 -45.67 134.21 14.07 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 F 24 ASP A 32 ASP.? 10.78 CL CL A 114 F 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 F 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -44.75 128.15 10.28 -45.68 129.67 11.55 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -50.43 131.90 19.60 -49.04 133.31 17.60 11.79 2.97 71.53 9.83 2.65 69.55 coo -44.10 135.86 19.99 -45.67 134.21 14.07 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 F 24 ASP A 32 ASP.? 10.78 CL CL A 114 F 146 TYR A 78 TYR~? 10.44 CL CL A 114 F 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -44.75 128.15 10.28 -45.68 129.67 11.55 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -50.43 131.90 19.60 -49.04 133.31 17.60 20.68 4.89 66.65 17.95 4.78 66.23 coo -44.10 135.86 19.99 -45.67 134.21 14.07 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 F 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 F 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 F 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -44.75 128.15 10.28 -45.68 129.67 11.55 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -50.43 131.90 19.60 -49.04 133.31 17.60 9.35 7.19 64.40 12.10 6.95 63.91 coo -44.10 135.86 19.99 -45.67 134.21 14.07 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 F 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 F 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s F 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -44.75 128.15 10.28 -45.68 129.67 11.55 0.49 28.13 88.01 2.42 28.83 88.55 coo -50.43 131.90 19.60 -49.04 133.31 17.60 7.36 24.77 79.77 8.81 23.32 81.62 coo -44.10 135.86 19.99 -45.67 134.21 14.07 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 F 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 F 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 F 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -44.75 128.15 10.28 -45.68 129.67 11.55 0.49 28.13 88.01 2.42 28.83 88.55 coo -50.43 131.90 19.60 -49.04 133.31 17.60 2.56 21.42 79.08 2.05 22.43 76.53 coo -44.10 135.86 19.99 -45.67 134.21 14.07 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 F 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 F 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 F 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -44.75 128.15 10.28 -45.68 129.67 11.55 0.49 28.13 88.01 2.42 28.83 88.55 coo -50.43 131.90 19.60 -49.04 133.31 17.60 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -44.10 135.86 19.99 -45.67 134.21 14.07 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 F 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 F 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 F 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -44.75 128.15 10.28 -45.68 129.67 11.55 4.69 24.83 64.29 4.38 25.55 62.31 coo -50.43 131.90 19.60 -49.04 133.31 17.60 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -44.10 135.86 19.99 -45.67 134.21 14.07 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c05 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c05 naa= 3 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 G 24 ASP A 32 ASP.? 10.78 CL CL A 114 G 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s G 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -44.97 128.78 41.20 -46.32 128.26 42.83 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -52.83 122.13 46.42 -51.31 124.30 47.39 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -47.30 122.24 51.49 -47.46 127.44 47.81 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 G 24 ASP A 32 ASP.? 10.78 CL CL A 114 G 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 G 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -44.97 128.78 41.20 -46.32 128.26 42.83 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -52.83 122.13 46.42 -51.31 124.30 47.39 11.79 2.97 71.53 9.83 2.65 69.55 coo -47.30 122.24 51.49 -47.46 127.44 47.81 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 G 24 ASP A 32 ASP.? 10.78 CL CL A 114 G 146 TYR A 78 TYR~? 10.44 CL CL A 114 G 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -44.97 128.78 41.20 -46.32 128.26 42.83 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -52.83 122.13 46.42 -51.31 124.30 47.39 20.68 4.89 66.65 17.95 4.78 66.23 coo -47.30 122.24 51.49 -47.46 127.44 47.81 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 G 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 G 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 G 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -44.97 128.78 41.20 -46.32 128.26 42.83 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -52.83 122.13 46.42 -51.31 124.30 47.39 9.35 7.19 64.40 12.10 6.95 63.91 coo -47.30 122.24 51.49 -47.46 127.44 47.81 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 G 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 G 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s G 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -44.97 128.78 41.20 -46.32 128.26 42.83 0.49 28.13 88.01 2.42 28.83 88.55 coo -52.83 122.13 46.42 -51.31 124.30 47.39 7.36 24.77 79.77 8.81 23.32 81.62 coo -47.30 122.24 51.49 -47.46 127.44 47.81 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 G 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 G 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 G 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -44.97 128.78 41.20 -46.32 128.26 42.83 0.49 28.13 88.01 2.42 28.83 88.55 coo -52.83 122.13 46.42 -51.31 124.30 47.39 2.56 21.42 79.08 2.05 22.43 76.53 coo -47.30 122.24 51.49 -47.46 127.44 47.81 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 G 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 G 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 G 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -44.97 128.78 41.20 -46.32 128.26 42.83 0.49 28.13 88.01 2.42 28.83 88.55 coo -52.83 122.13 46.42 -51.31 124.30 47.39 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -47.30 122.24 51.49 -47.46 127.44 47.81 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 G 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 G 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 G 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -44.97 128.78 41.20 -46.32 128.26 42.83 4.69 24.83 64.29 4.38 25.55 62.31 coo -52.83 122.13 46.42 -51.31 124.30 47.39 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -47.30 122.24 51.49 -47.46 127.44 47.81 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c06 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c06 naa= 3 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 H 24 ASP A 32 ASP.? 10.78 CL CL A 114 H 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s H 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -51.11 100.30 51.41 -52.67 98.82 51.12 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -58.70 94.17 45.32 -57.76 93.82 47.92 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -54.32 88.79 48.13 -54.61 94.04 51.74 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 H 24 ASP A 32 ASP.? 10.78 CL CL A 114 H 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 H 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -51.11 100.30 51.41 -52.67 98.82 51.12 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -58.70 94.17 45.32 -57.76 93.82 47.92 11.79 2.97 71.53 9.83 2.65 69.55 coo -54.32 88.79 48.13 -54.61 94.04 51.74 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 H 24 ASP A 32 ASP.? 10.78 CL CL A 114 H 146 TYR A 78 TYR~? 10.44 CL CL A 114 H 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -51.11 100.30 51.41 -52.67 98.82 51.12 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -58.70 94.17 45.32 -57.76 93.82 47.92 20.68 4.89 66.65 17.95 4.78 66.23 coo -54.32 88.79 48.13 -54.61 94.04 51.74 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 H 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 H 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 H 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -51.11 100.30 51.41 -52.67 98.82 51.12 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -58.70 94.17 45.32 -57.76 93.82 47.92 9.35 7.19 64.40 12.10 6.95 63.91 coo -54.32 88.79 48.13 -54.61 94.04 51.74 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 H 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 H 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s H 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -51.11 100.30 51.41 -52.67 98.82 51.12 0.49 28.13 88.01 2.42 28.83 88.55 coo -58.70 94.17 45.32 -57.76 93.82 47.92 7.36 24.77 79.77 8.81 23.32 81.62 coo -54.32 88.79 48.13 -54.61 94.04 51.74 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 H 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 H 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 H 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -51.11 100.30 51.41 -52.67 98.82 51.12 0.49 28.13 88.01 2.42 28.83 88.55 coo -58.70 94.17 45.32 -57.76 93.82 47.92 2.56 21.42 79.08 2.05 22.43 76.53 coo -54.32 88.79 48.13 -54.61 94.04 51.74 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 H 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 H 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 H 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -51.11 100.30 51.41 -52.67 98.82 51.12 0.49 28.13 88.01 2.42 28.83 88.55 coo -58.70 94.17 45.32 -57.76 93.82 47.92 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -54.32 88.79 48.13 -54.61 94.04 51.74 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 H 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 H 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 H 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -51.11 100.30 51.41 -52.67 98.82 51.12 4.69 24.83 64.29 4.38 25.55 62.31 coo -58.70 94.17 45.32 -57.76 93.82 47.92 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -54.32 88.79 48.13 -54.61 94.04 51.74 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c07 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c07 naa= 3 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 I 24 ASP A 32 ASP.? 10.78 CL CL A 114 I 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s I 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -54.65 81.97 26.87 -55.88 81.89 25.07 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -59.92 86.62 17.74 -59.42 83.94 18.40 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -55.38 81.61 14.50 -57.11 80.05 20.41 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 I 24 ASP A 32 ASP.? 10.78 CL CL A 114 I 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 I 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -54.65 81.97 26.87 -55.88 81.89 25.07 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -59.92 86.62 17.74 -59.42 83.94 18.40 11.79 2.97 71.53 9.83 2.65 69.55 coo -55.38 81.61 14.50 -57.11 80.05 20.41 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 I 24 ASP A 32 ASP.? 10.78 CL CL A 114 I 146 TYR A 78 TYR~? 10.44 CL CL A 114 I 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -54.65 81.97 26.87 -55.88 81.89 25.07 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -59.92 86.62 17.74 -59.42 83.94 18.40 20.68 4.89 66.65 17.95 4.78 66.23 coo -55.38 81.61 14.50 -57.11 80.05 20.41 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 I 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 I 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 I 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -54.65 81.97 26.87 -55.88 81.89 25.07 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -59.92 86.62 17.74 -59.42 83.94 18.40 9.35 7.19 64.40 12.10 6.95 63.91 coo -55.38 81.61 14.50 -57.11 80.05 20.41 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 I 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 I 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s I 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -54.65 81.97 26.87 -55.88 81.89 25.07 0.49 28.13 88.01 2.42 28.83 88.55 coo -59.92 86.62 17.74 -59.42 83.94 18.40 7.36 24.77 79.77 8.81 23.32 81.62 coo -55.38 81.61 14.50 -57.11 80.05 20.41 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 I 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 I 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 I 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -54.65 81.97 26.87 -55.88 81.89 25.07 0.49 28.13 88.01 2.42 28.83 88.55 coo -59.92 86.62 17.74 -59.42 83.94 18.40 2.56 21.42 79.08 2.05 22.43 76.53 coo -55.38 81.61 14.50 -57.11 80.05 20.41 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 I 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 I 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 I 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -54.65 81.97 26.87 -55.88 81.89 25.07 0.49 28.13 88.01 2.42 28.83 88.55 coo -59.92 86.62 17.74 -59.42 83.94 18.40 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -55.38 81.61 14.50 -57.11 80.05 20.41 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 I 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 I 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 I 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -54.65 81.97 26.87 -55.88 81.89 25.07 4.69 24.83 64.29 4.38 25.55 62.31 coo -59.92 86.62 17.74 -59.42 83.94 18.40 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -55.38 81.61 14.50 -57.11 80.05 20.41 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c08 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c08 naa= 3 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 J 24 ASP A 32 ASP.? 10.78 CL CL A 114 J 146 TYR A 27 TYR~? -3.63 C1 GOL A 115s J 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -50.64 99.08 1.52 -51.52 100.83 0.67 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 9.34 -1.01 75.16 10.26 -0.19 77.66 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 J 24 ASP A 32 ASP.? 10.78 CL CL A 114 J 146 TYR A 39 TYR^? 6.40 O1 GOL A 115 J 177 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -50.64 99.08 1.52 -51.52 100.83 0.67 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 11.79 2.97 71.53 9.83 2.65 69.55 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 J 24 ASP A 32 ASP.? 10.78 CL CL A 114 J 146 TYR A 78 TYR~? 10.44 CL CL A 114 J 177 LYS A 85 LYS~? 9.11 CL CL A 114 coo -50.64 99.08 1.52 -51.52 100.83 0.67 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 20.68 4.89 66.65 17.95 4.78 66.23 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 J 24 ASP A 62 ASP.? 15.17 O2 GOL A 115 J 146 TYR A 6 TYR^? 13.03 O1 GOL A 115 J 177 LYS A 92 LYS~? 15.91 CL CL A 114 coo -50.64 99.08 1.52 -51.52 100.83 0.67 -2.26 2.59 64.84 -3.73 2.30 63.39 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 9.35 7.19 64.40 12.10 6.95 63.91 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 J 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 J 146 TYR B 27 TYR~? -3.70 O3 AGOL B 114s J 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -50.64 99.08 1.52 -51.52 100.83 0.67 0.49 28.13 88.01 2.42 28.83 88.55 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 7.36 24.77 79.77 8.81 23.32 81.62 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 J 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 J 146 TYR B 39 TYR^? 6.45 O3 AGOL B 114 J 177 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -50.64 99.08 1.52 -51.52 100.83 0.67 0.49 28.13 88.01 2.42 28.83 88.55 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 2.56 21.42 79.08 2.05 22.43 76.53 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 3.47 17.87 83.94 8.53 16.31 82.03 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 7 3 # 7 J 24 ASP B 32 ASP.? 14.27 O1 BGOL B 114 J 146 TYR B 78 TYR~? 15.72 O3 AGOL B 114 J 177 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo -50.64 99.08 1.52 -51.52 100.83 0.67 0.49 28.13 88.01 2.42 28.83 88.55 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 -6.72 19.79 83.49 -5.56 20.39 81.01 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 8 3 # 8 J 24 ASP B 62 ASP.? 15.08 O2 BGOL B 114 J 146 TYR B 6 TYR^? 13.17 O3 AGOL B 114 J 177 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo -50.64 99.08 1.52 -51.52 100.83 0.67 4.69 24.83 64.29 4.38 25.55 62.31 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 -4.67 17.57 66.69 -7.33 13.35 64.02 1ok4_c09 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 8 hits 1ok4_c09 naa= 3 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 1 3 # 1 A 16 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 38 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 46 TRP A 87 TRP~? 11.00 O1 GOL A 115 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 11.79 2.97 71.53 9.83 2.65 69.55 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 14.09 -2.53 67.71 14.42 1.36 68.01 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 2 3 # 2 A 16 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 38 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 46 TRP B 87 TRP~? 10.98 O3 AGOL B 114 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 2.56 21.42 79.08 2.05 22.43 76.53 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 7.99 29.80 81.55 8.79 31.72 80.96 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 -1.46 27.41 80.24 -1.42 23.56 79.72 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 21 ALA~? 11.17 O3 GOL A 115 A 126 LEU A 24 LEU~? 5.94 O3 GOL A 115 A 158 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo -2.29 37.66 144.73 -1.46 37.12 145.87 2.19 -7.22 70.54 1.78 -8.67 70.28 coo -4.62 32.83 147.14 -5.50 32.85 149.12 4.71 -5.33 73.59 4.90 -5.68 75.75 coo -0.83 29.57 149.77 -0.39 31.47 148.95 9.84 -6.23 75.42 9.01 -8.17 75.63 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 107 ALA.? -3.07 O1 AGOL B 114s A 126 LEU B 24 LEU~? 5.58 O1 BGOL B 114 A 158 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo -2.29 37.66 144.73 -1.46 37.12 145.87 14.12 27.32 75.61 14.31 26.93 77.07 coo -4.62 32.83 147.14 -5.50 32.85 149.12 9.07 29.63 76.10 10.74 29.58 77.49 coo -0.83 29.57 149.77 -0.39 31.47 148.95 7.99 29.80 81.55 8.79 31.72 80.96 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA B 21 ALA~? 11.18 O1 AGOL B 114 A 126 LEU B 24 LEU~? 5.58 O1 BGOL B 114 A 158 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo -2.29 37.66 144.73 -1.46 37.12 145.87 8.31 32.49 72.77 8.50 34.05 72.50 coo -4.62 32.83 147.14 -5.50 32.85 149.12 9.07 29.63 76.10 10.74 29.58 77.49 coo -0.83 29.57 149.77 -0.39 31.47 148.95 7.99 29.80 81.55 8.79 31.72 80.96 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA B 107 ALA.? -3.19 O3 GOL A 115s A 126 LEU A 24 LEU~? 5.94 O3 GOL A 115 A 158 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo -2.29 37.66 144.73 -1.46 37.12 145.87 1.58 -3.35 77.81 2.77 -3.32 78.75 coo -4.62 32.83 147.14 -5.50 32.85 149.12 4.71 -5.33 73.59 4.90 -5.68 75.75 coo -0.83 29.57 149.77 -0.39 31.47 148.95 9.84 -6.23 75.42 9.01 -8.17 75.63 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 21 ALA~? 11.17 O3 GOL A 115 B 126 LEU A 24 LEU~? 5.94 O3 GOL A 115 B 158 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo -39.79 4.61 147.27 -39.61 5.56 148.47 2.19 -7.22 70.54 1.78 -8.67 70.28 coo -34.22 5.06 149.25 -33.65 4.24 151.15 4.71 -5.33 73.59 4.90 -5.68 75.75 coo -33.03 9.93 151.71 -34.98 9.38 151.11 9.84 -6.23 75.42 9.01 -8.17 75.63 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 107 ALA.? -3.07 O1 AGOL B 114s B 126 LEU B 24 LEU~? 5.58 O1 BGOL B 114 B 158 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo -39.79 4.61 147.27 -39.61 5.56 148.47 14.12 27.32 75.61 14.31 26.93 77.07 coo -34.22 5.06 149.25 -33.65 4.24 151.15 9.07 29.63 76.10 10.74 29.58 77.49 coo -33.03 9.93 151.71 -34.98 9.38 151.11 7.99 29.80 81.55 8.79 31.72 80.96 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA B 21 ALA~? 11.18 O1 AGOL B 114 B 126 LEU B 24 LEU~? 5.58 O1 BGOL B 114 B 158 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo -39.79 4.61 147.27 -39.61 5.56 148.47 8.31 32.49 72.77 8.50 34.05 72.50 coo -34.22 5.06 149.25 -33.65 4.24 151.15 9.07 29.63 76.10 10.74 29.58 77.49 coo -33.03 9.93 151.71 -34.98 9.38 151.11 7.99 29.80 81.55 8.79 31.72 80.96 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 B 70 ALA B 107 ALA.? -3.19 O3 GOL A 115s B 126 LEU A 24 LEU~? 5.94 O3 GOL A 115 B 158 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo -39.79 4.61 147.27 -39.61 5.56 148.47 1.58 -3.35 77.81 2.77 -3.32 78.75 coo -34.22 5.06 149.25 -33.65 4.24 151.15 4.71 -5.33 73.59 4.90 -5.68 75.75 coo -33.03 9.93 151.71 -34.98 9.38 151.11 9.84 -6.23 75.42 9.01 -8.17 75.63 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 21 ALA~? 11.17 O3 GOL A 115 C 126 LEU A 24 LEU~? 5.94 O3 GOL A 115 C 158 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 2.19 -7.22 70.54 1.78 -8.67 70.28 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 4.71 -5.33 73.59 4.90 -5.68 75.75 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 9.84 -6.23 75.42 9.01 -8.17 75.63 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 107 ALA.? -3.07 O1 AGOL B 114s C 126 LEU B 24 LEU~? 5.58 O1 BGOL B 114 C 158 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 14.12 27.32 75.61 14.31 26.93 77.07 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 9.07 29.63 76.10 10.74 29.58 77.49 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 7.99 29.80 81.55 8.79 31.72 80.96 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA B 21 ALA~? 11.18 O1 AGOL B 114 C 126 LEU B 24 LEU~? 5.58 O1 BGOL B 114 C 158 GLU B 28 GLU~? 8.04 O1 BGOL B 114 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 8.31 32.49 72.77 8.50 34.05 72.50 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 9.07 29.63 76.10 10.74 29.58 77.49 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 7.99 29.80 81.55 8.79 31.72 80.96 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA B 107 ALA.? -3.19 O3 GOL A 115s C 126 LEU A 24 LEU~? 5.94 O3 GOL A 115 C 158 GLU A 28 GLU~? 9.11 C3 GOL A 115 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 1.58 -3.35 77.81 2.77 -3.32 78.75 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 4.71 -5.33 73.59 4.90 -5.68 75.75 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 9.84 -6.23 75.42 9.01 -8.17 75.63 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c02 naa= 3 ULMN 3 1pyl_c00 RIBONUCLEASE user 1 3 # 1 A 56 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 67 ARG A 25 ARG~? 12.92 C1 GOL A 115 A 86 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 18.15 3.28 18.56 20.10 2.92 19.20 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 21.52 6.83 26.64 21.22 5.53 23.85 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1pyl_c00 RIBONUCLEASE user 2 3 # 2 A 56 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 67 ARG B 25 ARG~? 13.22 O1 BGOL B 114 A 86 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 18.15 3.28 18.56 20.10 2.92 19.20 7.99 29.80 81.55 8.79 31.72 80.96 coo 21.52 6.83 26.64 21.22 5.53 23.85 3.18 34.46 77.89 5.47 36.12 76.56 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1pyl_c00 RIBONUCLEASE user 3 3 # 3 A 56 GLU B 89 GLU~? 21.63 O3 AGOL B 114 A 67 ARG B 84 ARG~? 19.95 O3 AGOL B 114 A 86 HIS A 52 HIS.? 19.33 O3 AGOL B 114 coo 18.15 3.28 18.56 20.10 2.92 19.20 -9.38 32.01 77.42 -10.46 31.89 75.58 coo 21.52 6.83 26.64 21.22 5.53 23.85 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 -10.73 25.66 73.06 -8.90 25.80 74.09 1pyl_c00 source 1pyl RIBONUCLEASE : 3 hits 1pyl_c00 naa= 3 ULMN 3 1pyl_c01 RIBONUCLEASE user 1 3 # 1 B 56 GLU A 22 GLU~? 14.62 C1 GOL A 115 B 67 ARG A 25 ARG~? 12.92 C1 GOL A 115 B 86 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1pyl_c01 RIBONUCLEASE user 2 3 # 2 B 56 GLU A 89 GLU~? 16.58 CL CL A 114 B 67 ARG A 84 ARG~? 10.06 CL CL A 114 B 86 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 19.14 1.97 63.54 20.03 2.37 60.64 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1pyl_c01 RIBONUCLEASE user 3 3 # 3 B 56 GLU B 28 GLU~? 8.04 O1 BGOL B 114 B 67 ARG B 25 ARG~? 13.22 O1 BGOL B 114 B 86 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 7.99 29.80 81.55 8.79 31.72 80.96 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 3.18 34.46 77.89 5.47 36.12 76.56 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1pyl_c01 RIBONUCLEASE user 4 3 # 4 B 56 GLU B 89 GLU~? 21.63 O3 AGOL B 114 B 67 ARG B 84 ARG~? 19.95 O3 AGOL B 114 B 86 HIS A 52 HIS.? 19.33 O3 AGOL B 114 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 -9.38 32.01 77.42 -10.46 31.89 75.58 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 -10.73 25.66 73.06 -8.90 25.80 74.09 1pyl_c01 source 1pyl RIBONUCLEASE : 4 hits 1pyl_c01 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 68 ALA A 63 ALA^? 8.96 O2 GOL A 115 A 72 LEU A 7 LEU^? 15.37 O1 GOL A 115 coo 46.76 7.59 18.65 45.27 6.01 18.52 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 48.88 4.35 16.59 48.73 5.09 15.20 0.68 4.48 67.73 1.38 3.15 67.92 coo 53.89 6.25 15.09 52.88 7.92 14.14 2.85 9.63 63.12 2.25 11.51 64.04 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 68 ALA A 63 ALA^? 8.96 O2 GOL A 115 A 72 LEU A 43 LEU^? 7.78 O2 GOL A 115 coo 46.76 7.59 18.65 45.27 6.01 18.52 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 48.88 4.35 16.59 48.73 5.09 15.20 0.68 4.48 67.73 1.38 3.15 67.92 coo 53.89 6.25 15.09 52.88 7.92 14.14 -1.97 2.24 71.67 -1.75 0.15 71.21 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 # 3 A 67 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 68 ALA B 63 ALA^? 8.86 O2 BGOL B 114 A 72 LEU B 7 LEU^? 15.26 O2 AGOL B 114 coo 46.76 7.59 18.65 45.27 6.01 18.52 4.69 24.83 64.29 4.38 25.55 62.31 coo 48.88 4.35 16.59 48.73 5.09 15.20 5.28 21.90 67.77 5.16 23.05 68.78 coo 53.89 6.25 15.09 52.88 7.92 14.14 0.09 17.58 65.96 0.89 15.60 65.66 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 # 4 A 67 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 68 ALA B 63 ALA^? 8.86 O2 BGOL B 114 A 72 LEU B 43 LEU^? 7.63 O2 BGOL B 114 coo 46.76 7.59 18.65 45.27 6.01 18.52 4.69 24.83 64.29 4.38 25.55 62.31 coo 48.88 4.35 16.59 48.73 5.09 15.20 5.28 21.90 67.77 5.16 23.05 68.78 coo 53.89 6.25 15.09 52.88 7.92 14.14 10.34 23.67 68.18 10.06 25.74 68.52 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 4 hits 1q6l_c05 naa= 3 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 1 3 # 1 A 189 SER A 30 SER~? 7.32 O1 GOL A 115 A 310 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 399 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 2.67 37.96 55.23 1.78 40.01 56.16 15.10 -1.32 71.94 13.61 -0.13 73.45 coo 6.61 38.44 63.61 6.69 38.31 61.50 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 4.95 41.82 59.53 3.85 40.70 58.14 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 2 3 # 2 A 189 SER B 30 SER~? 7.11 O3 AGOL B 114 A 310 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 399 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 2.67 37.96 55.23 1.78 40.01 56.16 1.68 25.09 82.95 3.64 23.84 82.25 coo 6.61 38.44 63.61 6.69 38.31 61.50 7.99 29.80 81.55 8.79 31.72 80.96 coo 4.95 41.82 59.53 3.85 40.70 58.14 5.80 25.06 85.89 7.38 24.42 84.67 1qe3_c00 source 1qe3 PARA-NITROBENZYL ESTERASE : 2 hits 1qe3_c00 naa= 3 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 A 86 GLU A 22 GLU~? 14.62 C1 GOL A 115 A 143 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 170 LYS A 92 LYS~? 15.91 CL CL A 114 coo -2.40 27.37 52.92 -1.22 29.09 52.71 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 1.36 26.79 49.43 3.17 26.89 50.50 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 7.24 31.80 48.14 6.27 25.92 49.70 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 2 3 # 2 A 86 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 143 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 170 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo -2.40 27.37 52.92 -1.22 29.09 52.71 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 1.36 26.79 49.43 3.17 26.89 50.50 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 7.24 31.80 48.14 6.27 25.92 49.70 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 3 3 # 3 A 86 GLU B 22 GLU~? 14.39 O1 BGOL B 114 A 143 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 170 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo -2.40 27.37 52.92 -1.22 29.09 52.71 3.40 33.72 72.05 2.78 34.87 73.76 coo 1.36 26.79 49.43 3.17 26.89 50.50 -1.03 31.78 76.72 0.89 32.00 75.91 coo 7.24 31.80 48.14 6.27 25.92 49.70 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 4 3 # 4 A 86 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 143 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 170 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo -2.40 27.37 52.92 -1.22 29.09 52.71 7.99 29.80 81.55 8.79 31.72 80.96 coo 1.36 26.79 49.43 3.17 26.89 50.50 5.80 25.06 85.89 7.38 24.42 84.67 coo 7.24 31.80 48.14 6.27 25.92 49.70 3.47 17.87 83.94 8.53 16.31 82.03 1qfe_c00 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 4 hits 1qfe_c00 naa= 3 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 B 86 GLU A 22 GLU~? 14.62 C1 GOL A 115 B 143 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 170 LYS A 92 LYS~? 15.91 CL CL A 114 coo 13.90 37.16 5.96 12.00 36.26 6.12 3.69 -7.10 65.54 5.12 -8.60 65.19 coo 13.52 33.69 9.79 13.20 31.83 8.88 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 7.52 28.83 11.02 13.59 28.74 9.95 9.32 -0.83 59.34 13.60 2.28 58.11 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 2 3 # 2 B 86 GLU A 28 GLU~? 9.11 C3 GOL A 115 B 143 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 170 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 13.90 37.16 5.96 12.00 36.26 6.12 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 13.52 33.69 9.79 13.20 31.83 8.88 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 7.52 28.83 11.02 13.59 28.74 9.95 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 3 3 # 3 B 86 GLU B 28 GLU~? 8.04 O1 BGOL B 114 B 143 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 170 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 13.90 37.16 5.96 12.00 36.26 6.12 7.99 29.80 81.55 8.79 31.72 80.96 coo 13.52 33.69 9.79 13.20 31.83 8.88 5.80 25.06 85.89 7.38 24.42 84.67 coo 7.52 28.83 11.02 13.59 28.74 9.95 3.47 17.87 83.94 8.53 16.31 82.03 1qfe_c01 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 3 hits 1qfe_c01 naa= 3 ULMN 3 1qfl_c00 ACETOACETYL-COA THIOLASE user 1 3 # 1 A 348 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 378 CYH A 23 CYH~? 8.53 O2 GOL A 115 A 380 GLY A 65 GLY^? 7.74 O1 GOL A 115 coo 28.93 -15.66 12.20 27.40 -15.25 10.79 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 22.08 -17.67 5.57 22.76 -18.91 8.05 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 18.19 -14.51 10.52 18.01 -14.23 9.79 7.16 5.92 68.88 6.95 6.74 68.72 1qfl_c00 source 1qfl ACETOACETYL-COA THIOLASE : 1 hits 1qfl_c00 naa= 3 ULMN 3 1qfl_c01 ACETOACETYL-COA THIOLASE user 1 3 # 1 B 348 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 378 CYH A 23 CYH~? 8.53 O2 GOL A 115 B 380 GLY A 65 GLY^? 7.74 O1 GOL A 115 coo 13.24 15.55 12.21 14.75 15.10 10.80 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 20.14 17.58 5.68 19.50 18.95 7.99 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 24.06 14.49 10.58 24.24 14.15 9.79 7.16 5.92 68.88 6.95 6.74 68.72 1qfl_c01 source 1qfl ACETOACETYL-COA THIOLASE : 1 hits 1qfl_c01 naa= 3 ULMN 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 1 3 # 1 C 348 HIS A 90 HIS~? 13.16 C1 GOL A 115 C 378 CYH A 23 CYH~? 8.53 O2 GOL A 115 C 380 GLY A 65 GLY^? 7.74 O1 GOL A 115 coo 39.92 0.27 55.80 38.80 1.56 57.03 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 38.90 7.44 62.34 40.19 7.59 59.85 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 34.29 9.51 57.55 33.93 9.43 58.29 7.16 5.92 68.88 6.95 6.74 68.72 1qfl_c02 source 1qfl ACETOACETYL-COA THIOLASE : 1 hits 1qfl_c02 naa= 3 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 75 TYR~? 14.24 CL CL A 114 A 236 ASP A 71 ASP~? 16.51 CL CL A 114 A 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 55.48 26.51 40.65 55.39 23.99 39.43 21.81 10.09 65.59 20.00 9.75 63.52 coo 48.87 29.19 44.63 49.10 27.34 43.63 25.70 13.65 72.38 26.87 11.94 72.89 coo 47.58 17.35 41.83 51.40 20.85 40.83 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 A 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 55.48 26.51 40.65 55.39 23.99 39.43 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 48.87 29.19 44.63 49.10 27.34 43.63 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 47.58 17.35 41.83 51.40 20.85 40.83 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 B 236 ASP A 71 ASP~? 16.51 CL CL A 114 B 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 21.81 10.09 65.59 20.00 9.75 63.52 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 25.70 13.65 72.38 26.87 11.94 72.89 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 B 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 C 236 ASP A 71 ASP~? 16.51 CL CL A 114 C 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 39.51 34.34 13.63 37.63 32.61 14.79 21.81 10.09 65.59 20.00 9.75 63.52 coo 45.78 31.11 9.51 44.25 30.06 10.53 25.70 13.65 72.38 26.87 11.94 72.89 coo 37.54 22.37 12.10 37.83 27.55 13.24 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 C 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 C 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 39.51 34.34 13.63 37.63 32.61 14.79 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 45.78 31.11 9.51 44.25 30.06 10.53 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 37.54 22.37 12.10 37.83 27.55 13.24 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 D 236 ASP A 71 ASP~? 16.51 CL CL A 114 D 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 21.81 10.09 65.59 20.00 9.75 63.52 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 25.70 13.65 72.38 26.87 11.94 72.89 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 D 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 D 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 E 236 ASP A 71 ASP~? 16.51 CL CL A 114 E 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 21.81 10.09 65.59 20.00 9.75 63.52 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 25.70 13.65 72.38 26.87 11.94 72.89 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 E 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 E 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 F 236 ASP A 71 ASP~? 16.51 CL CL A 114 F 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 21.81 10.09 65.59 20.00 9.75 63.52 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 25.70 13.65 72.38 26.87 11.94 72.89 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 F 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 F 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 G 236 ASP A 71 ASP~? 16.51 CL CL A 114 G 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 21.81 10.09 65.59 20.00 9.75 63.52 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 25.70 13.65 72.38 26.87 11.94 72.89 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 G 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 G 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 3.47 17.87 83.94 8.53 16.31 82.03 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 75 TYR~? 14.24 CL CL A 114 H 236 ASP A 71 ASP~? 16.51 CL CL A 114 H 261 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 21.81 10.09 65.59 20.00 9.75 63.52 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 25.70 13.65 72.38 26.87 11.94 72.89 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 H 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 H 261 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 3.47 17.87 83.94 8.53 16.31 82.03 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 84 ARG~? 10.06 CL CL A 114 C 163 TYR A 75 TYR~? 14.24 CL CL A 114 C 236 ASP A 71 ASP~? 16.51 CL CL A 114 coo 39.01 29.77 22.02 37.48 31.30 19.84 19.14 1.97 63.54 20.03 2.37 60.64 coo 39.51 34.34 13.63 37.63 32.61 14.79 21.81 10.09 65.59 20.00 9.75 63.52 coo 45.78 31.11 9.51 44.25 30.06 10.53 25.70 13.65 72.38 26.87 11.94 72.89 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG A 84 ARG~? 10.06 CL CL A 114 C 163 TYR A 75 TYR~? 14.24 CL CL A 114 C 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 coo 39.01 29.77 22.02 37.48 31.30 19.84 19.14 1.97 63.54 20.03 2.37 60.64 coo 39.51 34.34 13.63 37.63 32.61 14.79 21.81 10.09 65.59 20.00 9.75 63.52 coo 45.78 31.11 9.51 44.25 30.06 10.53 26.30 14.43 67.36 25.07 16.12 67.01 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 C 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 C 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 39.01 29.77 22.02 37.48 31.30 19.84 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 39.51 34.34 13.63 37.63 32.61 14.79 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 45.78 31.11 9.51 44.25 30.06 10.53 -5.76 9.33 88.77 -5.88 10.77 90.36 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 C 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 C 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 coo 39.01 29.77 22.02 37.48 31.30 19.84 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 39.51 34.34 13.63 37.63 32.61 14.79 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 45.78 31.11 9.51 44.25 30.06 10.53 -10.25 9.55 86.42 -10.16 8.13 84.85 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 C 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 C 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 39.01 29.77 22.02 37.48 31.30 19.84 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 39.51 34.34 13.63 37.63 32.61 14.79 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 45.78 31.11 9.51 44.25 30.06 10.53 -5.76 9.33 88.77 -5.88 10.77 90.36 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 84 ARG~? 10.06 CL CL A 114 D 163 TYR A 75 TYR~? 14.24 CL CL A 114 D 236 ASP A 71 ASP~? 16.51 CL CL A 114 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 19.14 1.97 63.54 20.03 2.37 60.64 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 21.81 10.09 65.59 20.00 9.75 63.52 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 25.70 13.65 72.38 26.87 11.94 72.89 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG A 84 ARG~? 10.06 CL CL A 114 D 163 TYR A 75 TYR~? 14.24 CL CL A 114 D 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 19.14 1.97 63.54 20.03 2.37 60.64 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 21.81 10.09 65.59 20.00 9.75 63.52 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 26.30 14.43 67.36 25.07 16.12 67.01 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 D 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 D 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -5.76 9.33 88.77 -5.88 10.77 90.36 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 D 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 D 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -10.25 9.55 86.42 -10.16 8.13 84.85 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 D 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 D 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -5.76 9.33 88.77 -5.88 10.77 90.36 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 75 TYR~? 14.24 CL CL A 114 A 236 ASP A 71 ASP~? 16.51 CL CL A 114 C 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 55.48 26.51 40.65 55.39 23.99 39.43 21.81 10.09 65.59 20.00 9.75 63.52 coo 48.87 29.19 44.63 49.10 27.34 43.63 25.70 13.65 72.38 26.87 11.94 72.89 coo 52.39 23.42 32.10 54.51 23.27 34.29 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR A 75 TYR~? 14.24 CL CL A 114 A 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 C 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 55.48 26.51 40.65 55.39 23.99 39.43 21.81 10.09 65.59 20.00 9.75 63.52 coo 48.87 29.19 44.63 49.10 27.34 43.63 26.30 14.43 67.36 25.07 16.12 67.01 coo 52.39 23.42 32.10 54.51 23.27 34.29 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 C 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 55.48 26.51 40.65 55.39 23.99 39.43 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 48.87 29.19 44.63 49.10 27.34 43.63 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 52.39 23.42 32.10 54.51 23.27 34.29 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 C 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 55.48 26.51 40.65 55.39 23.99 39.43 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 48.87 29.19 44.63 49.10 27.34 43.63 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 52.39 23.42 32.10 54.51 23.27 34.29 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 C 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 55.48 26.51 40.65 55.39 23.99 39.43 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 48.87 29.19 44.63 49.10 27.34 43.63 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 52.39 23.42 32.10 54.51 23.27 34.29 -8.32 22.59 81.65 -10.97 23.53 80.37 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 75 TYR~? 14.24 CL CL A 114 B 236 ASP A 71 ASP~? 16.51 CL CL A 114 D 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 21.81 10.09 65.59 20.00 9.75 63.52 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 25.70 13.65 72.38 26.87 11.94 72.89 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR A 75 TYR~? 14.24 CL CL A 114 B 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 D 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 21.81 10.09 65.59 20.00 9.75 63.52 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 26.30 14.43 67.36 25.07 16.12 67.01 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 D 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 D 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 D 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -8.32 22.59 81.65 -10.97 23.53 80.37 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG A 84 ARG~? 10.06 CL CL A 114 G 163 TYR A 75 TYR~? 14.24 CL CL A 114 G 236 ASP A 71 ASP~? 16.51 CL CL A 114 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 19.14 1.97 63.54 20.03 2.37 60.64 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 21.81 10.09 65.59 20.00 9.75 63.52 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 25.70 13.65 72.38 26.87 11.94 72.89 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG A 84 ARG~? 10.06 CL CL A 114 G 163 TYR A 75 TYR~? 14.24 CL CL A 114 G 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 19.14 1.97 63.54 20.03 2.37 60.64 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 21.81 10.09 65.59 20.00 9.75 63.52 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 26.30 14.43 67.36 25.07 16.12 67.01 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 G 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 G 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -5.76 9.33 88.77 -5.88 10.77 90.36 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 E 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 G 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 G 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -10.25 9.55 86.42 -10.16 8.13 84.85 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 E 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 G 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 G 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -5.76 9.33 88.77 -5.88 10.77 90.36 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 84 ARG~? 10.06 CL CL A 114 H 163 TYR A 75 TYR~? 14.24 CL CL A 114 H 236 ASP A 71 ASP~? 16.51 CL CL A 114 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 19.14 1.97 63.54 20.03 2.37 60.64 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 21.81 10.09 65.59 20.00 9.75 63.52 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 25.70 13.65 72.38 26.87 11.94 72.89 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG A 84 ARG~? 10.06 CL CL A 114 H 163 TYR A 75 TYR~? 14.24 CL CL A 114 H 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 19.14 1.97 63.54 20.03 2.37 60.64 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 21.81 10.09 65.59 20.00 9.75 63.52 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 26.30 14.43 67.36 25.07 16.12 67.01 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 H 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 H 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -5.76 9.33 88.77 -5.88 10.77 90.36 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 F 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 H 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 H 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -10.25 9.55 86.42 -10.16 8.13 84.85 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 F 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 H 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 H 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -5.76 9.33 88.77 -5.88 10.77 90.36 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 75 TYR~? 14.24 CL CL A 114 E 236 ASP A 71 ASP~? 16.51 CL CL A 114 G 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 21.81 10.09 65.59 20.00 9.75 63.52 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 25.70 13.65 72.38 26.87 11.94 72.89 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR A 75 TYR~? 14.24 CL CL A 114 E 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 G 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 21.81 10.09 65.59 20.00 9.75 63.52 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 26.30 14.43 67.36 25.07 16.12 67.01 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 E 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 G 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 E 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 E 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 G 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 E 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 E 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 G 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -8.32 22.59 81.65 -10.97 23.53 80.37 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 75 TYR~? 14.24 CL CL A 114 F 236 ASP A 71 ASP~? 16.51 CL CL A 114 H 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 21.81 10.09 65.59 20.00 9.75 63.52 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 25.70 13.65 72.38 26.87 11.94 72.89 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR A 75 TYR~? 14.24 CL CL A 114 F 236 ASP A 72 ASP~? 17.54 O2 AGOL B 114 H 110 ARG A 84 ARG~? 10.06 CL CL A 114 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 21.81 10.09 65.59 20.00 9.75 63.52 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 26.30 14.43 67.36 25.07 16.12 67.01 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 19.14 1.97 63.54 20.03 2.37 60.64 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 F 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 H 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 F 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 F 236 ASP B 71 ASP~? 19.48 O2 GOL A 115 H 110 ARG B 102 ARG^? 14.15 O2 GOL A 115 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 -7.93 9.11 76.54 -9.19 6.36 75.80 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 F 163 TYR B 75 TYR~? 19.43 O3 BGOL B 114 F 236 ASP B 72 ASP~? 17.82 O3 GOL A 115 H 110 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 -8.32 22.59 81.65 -10.97 23.53 80.37 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c23 naa= 3 ULMN 3 1qrz_c20 PLASMINOGEN user 1 3 # 1 A 603 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 646 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 739 GLY B 65 GLY^? 7.90 O3 AGOL B 114 coo -20.72 2.99 34.37 -21.94 1.82 35.61 4.96 22.92 58.66 6.72 23.67 59.53 coo -18.83 7.68 26.86 -20.89 7.78 26.56 9.86 30.83 63.58 9.25 29.72 61.91 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 2.73 19.42 73.25 2.63 18.67 72.86 1qrz_c20 source 1qrz PLASMINOGEN : 1 hits 1qrz_c20 naa= 3 ULMN 3 1qrz_c21 PLASMINOGEN user 1 3 # 1 B 603 HIS B 60 HIS.? 17.24 O2 AGOL B 114 B 646 ASP B 16 ASP~? 15.56 O2 BGOL B 114 B 739 GLY B 65 GLY^? 7.90 O3 AGOL B 114 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 4.96 22.92 58.66 6.72 23.67 59.53 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 9.86 30.83 63.58 9.25 29.72 61.91 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 2.73 19.42 73.25 2.63 18.67 72.86 1qrz_c21 source 1qrz PLASMINOGEN : 1 hits 1qrz_c21 naa= 3 ULMN 3 1qrz_c22 PLASMINOGEN user 1 3 # 1 C 603 HIS B 60 HIS.? 17.24 O2 AGOL B 114 C 646 ASP B 16 ASP~? 15.56 O2 BGOL B 114 C 739 GLY B 65 GLY^? 7.90 O3 AGOL B 114 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 4.96 22.92 58.66 6.72 23.67 59.53 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 9.86 30.83 63.58 9.25 29.72 61.91 coo 7.82 1.25 3.03 7.30 1.31 3.65 2.73 19.42 73.25 2.63 18.67 72.86 1qrz_c22 source 1qrz PLASMINOGEN : 1 hits 1qrz_c22 naa= 3 ULMN 3 1qrz_c23 PLASMINOGEN user 1 3 # 1 D 603 HIS B 60 HIS.? 17.24 O2 AGOL B 114 D 646 ASP B 16 ASP~? 15.56 O2 BGOL B 114 D 739 GLY B 65 GLY^? 7.90 O3 AGOL B 114 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 4.96 22.92 58.66 6.72 23.67 59.53 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 9.86 30.83 63.58 9.25 29.72 61.91 coo -45.82 1.31 41.67 -46.38 1.39 42.31 2.73 19.42 73.25 2.63 18.67 72.86 1qrz_c23 source 1qrz PLASMINOGEN : 1 hits 1qrz_c23 naa= 3 ULMN 3 1rbn_c01 RIBONUCLEASE A (E.C.3.1.27.5) DERIVAuser 1 3 # 1 A 12 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 41 LYS A 85 LYS~? 9.11 CL CL A 114 A 119 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 27.25 41.76 -6.97 28.67 40.32 -7.25 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 35.53 36.24 -0.58 31.10 37.46 -4.56 19.43 -1.95 61.52 24.42 -0.23 58.09 coo 26.49 34.97 -12.73 26.25 33.07 -12.07 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1rbn_c01 RIBONUCLEASE A (E.C.3.1.27.5) DERIVAuser 2 3 # 2 A 12 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 41 LYS B 85 LYS~? 25.09 O3 AGOL B 114 A 119 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 27.25 41.76 -6.97 28.67 40.32 -7.25 0.85 27.13 76.55 -1.16 26.55 76.75 coo 35.53 36.24 -0.58 31.10 37.46 -4.56 -9.57 27.75 81.15 -15.18 26.42 83.82 coo 26.49 34.97 -12.73 26.25 33.07 -12.07 5.80 25.06 85.89 7.38 24.42 84.67 1rbn_c01 source 1rbn RIBONUCLEASE A (E.C.3.1.27.5) DERIVATIVE II CO: 2 hits 1rbn_c01 naa= 3 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 1 3 # 1 A 608 ASP A 32 ASP.? 10.78 CL CL A 114 A 610 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 661 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 75.99 81.56 1.86 73.91 81.34 2.28 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 71.04 78.84 0.46 71.54 76.90 1.02 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 75.40 81.38 12.06 74.88 79.42 12.63 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 2 3 # 2 A 608 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 610 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 661 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 75.99 81.56 1.86 73.91 81.34 2.28 0.49 28.13 88.01 2.42 28.83 88.55 coo 71.04 78.84 0.46 71.54 76.90 1.02 5.80 25.06 85.89 7.38 24.42 84.67 coo 75.40 81.38 12.06 74.88 79.42 12.63 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 3 3 # 3 A 608 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 610 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 661 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 75.99 81.56 1.86 73.91 81.34 2.28 0.49 28.13 88.01 2.42 28.83 88.55 coo 71.04 78.84 0.46 71.54 76.90 1.02 5.80 25.06 85.89 7.38 24.42 84.67 coo 75.40 81.38 12.06 74.88 79.42 12.63 -1.03 31.78 76.72 0.89 32.00 75.91 1req_c10 source 1req METHYLMALONYL-COA MUTASE : 3 hits 1req_c10 naa= 3 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 1 3 # 1 C 608 ASP A 32 ASP.? 10.78 CL CL A 114 C 610 HIS A 31 HIS~? 8.53 C1 GOL A 115 C 661 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo -17.65 80.52 58.00 -16.23 80.79 56.41 19.63 -5.14 72.66 19.01 -6.45 74.22 coo -16.56 83.18 53.03 -16.33 85.18 53.60 15.30 -2.41 76.92 13.57 -1.61 77.79 coo -8.38 80.78 62.24 -7.53 82.67 62.02 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 2 3 # 2 C 608 ASP B 32 ASP.? 14.27 O1 BGOL B 114 C 610 HIS B 31 HIS~? 8.39 O3 AGOL B 114 C 661 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -17.65 80.52 58.00 -16.23 80.79 56.41 0.49 28.13 88.01 2.42 28.83 88.55 coo -16.56 83.18 53.03 -16.33 85.18 53.60 5.80 25.06 85.89 7.38 24.42 84.67 coo -8.38 80.78 62.24 -7.53 82.67 62.02 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 3 3 # 3 C 608 ASP B 32 ASP.? 14.27 O1 BGOL B 114 C 610 HIS B 31 HIS~? 8.39 O3 AGOL B 114 C 661 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo -17.65 80.52 58.00 -16.23 80.79 56.41 0.49 28.13 88.01 2.42 28.83 88.55 coo -16.56 83.18 53.03 -16.33 85.18 53.60 5.80 25.06 85.89 7.38 24.42 84.67 coo -8.38 80.78 62.24 -7.53 82.67 62.02 -1.03 31.78 76.72 0.89 32.00 75.91 1req_c11 source 1req METHYLMALONYL-COA MUTASE : 3 hits 1req_c11 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 35 SER B 15 SER~? 17.11 O1 AGOL B 114 215 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 11.85 17.24 72.81 11.09 15.37 72.36 9.86 30.83 63.58 9.25 29.72 61.91 coo 12.20 12.71 75.45 13.69 13.84 74.03 6.70 34.48 63.20 7.42 36.00 64.96 coo 5.22 15.03 71.43 7.19 14.88 70.83 4.69 24.83 64.29 4.38 25.55 62.31 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 1 hits 1rne_c04 naa= 3 ULMN 3 1ro7_c03 ALPHA-2,3/8-SIALYLTRANSFERASE user 1 3 # 1 D 129 ARG B 25 ARG~? 13.22 O1 BGOL B 114 D 156 TYR B 39 TYR^? 6.45 O3 AGOL B 114 D 188 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo -19.99 -38.81 30.91 -19.99 -39.90 28.04 3.18 34.46 77.89 5.47 36.12 76.56 coo -32.96 -44.88 30.49 -32.31 -42.65 28.92 2.56 21.42 79.08 2.05 22.43 76.53 coo -25.33 -42.26 31.79 -24.77 -40.56 30.70 0.85 27.13 76.55 -1.16 26.55 76.75 1ro7_c03 source 1ro7 ALPHA-2,3/8-SIALYLTRANSFERASE : 1 hits 1ro7_c03 naa= 3 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 A 137 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 288 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 329 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 29.27 18.78 14.99 27.16 18.62 14.76 7.17 5.83 75.53 6.75 7.34 76.93 coo 49.52 10.06 10.36 50.99 9.65 8.92 0.85 27.13 76.55 -1.16 26.55 76.75 coo 57.80 12.92 13.83 53.77 8.42 12.15 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 A 137 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 288 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 329 LYS A 85 LYS~? 9.11 CL CL A 114 coo 29.27 18.78 14.99 27.16 18.62 14.76 8.17 18.37 77.00 9.28 16.58 76.89 coo 49.52 10.06 10.36 50.99 9.65 8.92 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 57.80 12.92 13.83 53.77 8.42 12.15 19.43 -1.95 61.52 24.42 -0.23 58.09 1roz_c00 source 1roz DEOXYHYPUSINE SYNTHASE : 2 hits 1roz_c00 naa= 3 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 B 137 GLU A 40 GLU^? -5.26 O1 GOL A 115s B 288 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 329 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 7.17 5.83 75.53 6.75 7.34 76.93 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 0.85 27.13 76.55 -1.16 26.55 76.75 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 B 137 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 288 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 329 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 10.15 10.32 71.63 9.22 11.91 72.68 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 -1.03 31.78 76.72 0.89 32.00 75.91 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 -9.57 27.75 81.15 -15.18 26.42 83.82 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 3 3 # 3 B 137 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B 288 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 329 LYS A 85 LYS~? 9.11 CL CL A 114 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 8.17 18.37 77.00 9.28 16.58 76.89 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 19.43 -1.95 61.52 24.42 -0.23 58.09 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 4 3 # 4 B 137 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B 288 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 329 LYS A 85 LYS~? 9.11 CL CL A 114 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 2.66 14.38 76.39 3.95 12.75 76.00 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 19.43 -1.95 61.52 24.42 -0.23 58.09 1roz_c01 source 1roz DEOXYHYPUSINE SYNTHASE : 4 hits 1roz_c01 naa= 3 ULMN 3 1rtu_c00 RIBONUCLEASE U2 user 1 3 # 1 41 HIS B 31 HIS~? 8.39 O3 AGOL B 114 62 GLU B 28 GLU~? 8.04 O1 BGOL B 114 101 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 13.91 26.31 13.70 14.98 27.08 12.06 5.80 25.06 85.89 7.38 24.42 84.67 coo 9.15 26.32 13.85 8.75 28.20 13.02 7.99 29.80 81.55 8.79 31.72 80.96 coo 7.90 34.31 7.89 9.24 33.73 9.42 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 1rtu_c00 RIBONUCLEASE U2 user 2 3 # 2 41 HIS B 31 HIS~? 8.39 O3 AGOL B 114 62 GLU B 28 GLU~? 8.04 O1 BGOL B 114 101 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 13.91 26.31 13.70 14.98 27.08 12.06 5.80 25.06 85.89 7.38 24.42 84.67 coo 9.15 26.32 13.85 8.75 28.20 13.02 7.99 29.80 81.55 8.79 31.72 80.96 coo 7.90 34.31 7.89 9.24 33.73 9.42 -1.03 31.78 76.72 0.89 32.00 75.91 1rtu_c00 source 1rtu RIBONUCLEASE U2 : 2 hits 1rtu_c00 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 32 ASP.? 10.78 CL CL A 114 595 GLU A 28 GLU~? 9.11 C3 GOL A 115 713 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 5.64 2.82 38.49 4.59 4.19 37.25 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 4.35 13.73 37.63 3.39 12.18 36.55 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 3.76 10.25 31.38 3.16 9.87 34.10 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 1sll_c00 SIALIDASE L user 2 3 # 2 318 ASP B 32 ASP.? 14.27 O1 BGOL B 114 595 GLU B 28 GLU~? 8.04 O1 BGOL B 114 713 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 5.64 2.82 38.49 4.59 4.19 37.25 0.49 28.13 88.01 2.42 28.83 88.55 coo 4.35 13.73 37.63 3.39 12.18 36.55 7.99 29.80 81.55 8.79 31.72 80.96 coo 3.76 10.25 31.38 3.16 9.87 34.10 7.36 24.77 79.77 8.81 23.32 81.62 1sll_c00 source 1sll SIALIDASE L : 2 hits 1sll_c00 naa= 3 ULMN 3 1sme_c04 PLASMEPSIN II user 1 3 # 1 A 34 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 37 SER B 15 SER~? 17.11 O1 AGOL B 114 A 214 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 51.75 60.57 19.10 52.05 60.90 21.19 9.86 30.83 63.58 9.25 29.72 61.91 coo 51.10 65.11 20.73 52.62 63.74 19.42 6.70 34.48 63.20 7.42 36.00 64.96 coo 48.59 58.89 25.78 50.13 59.74 24.61 4.69 24.83 64.29 4.38 25.55 62.31 1sme_c04 source 1sme PLASMEPSIN II : 1 hits 1sme_c04 naa= 3 ULMN 3 1sme_c05 PLASMEPSIN II user 1 3 # 1 B 34 ASP A 16 ASP~? 16.03 O2 GOL A 115 B 37 SER A 15 SER~? 16.97 O3 GOL A 115 B 214 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 17.69 97.58 52.73 17.33 97.19 54.77 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 20.67 100.44 55.84 20.21 98.51 54.45 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo 12.41 98.71 58.47 14.37 98.17 58.05 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 1sme_c05 PLASMEPSIN II user 2 3 # 2 B 34 ASP B 16 ASP~? 15.56 O2 BGOL B 114 B 37 SER B 15 SER~? 17.11 O1 AGOL B 114 B 214 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 17.69 97.58 52.73 17.33 97.19 54.77 9.86 30.83 63.58 9.25 29.72 61.91 coo 20.67 100.44 55.84 20.21 98.51 54.45 6.70 34.48 63.20 7.42 36.00 64.96 coo 12.41 98.71 58.47 14.37 98.17 58.05 4.69 24.83 64.29 4.38 25.55 62.31 1sme_c05 source 1sme PLASMEPSIN II : 2 hits 1sme_c05 naa= 3 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP A 16 ASP~? 16.03 O2 GOL A 115 E 168 LYS A 10 LYS.? 17.78 O2 GOL A 115 E 201 THR A 18 THR~? 16.16 O3 GOL A 115 coo 5.36 16.20 22.10 3.88 17.00 23.31 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 5.06 22.32 18.11 1.02 22.08 22.74 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo -1.79 18.29 19.05 -1.19 20.28 19.71 -0.94 -8.43 66.77 -0.62 -9.76 65.12 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 2 3 # 2 E 166 ASP B 16 ASP~? 15.56 O2 BGOL B 114 E 168 LYS B 10 LYS.? 17.18 O2 BGOL B 114 E 201 THR B 18 THR~? 16.12 O1 AGOL B 114 coo 5.36 16.20 22.10 3.88 17.00 23.31 9.86 30.83 63.58 9.25 29.72 61.91 coo 5.06 22.32 18.11 1.02 22.08 22.74 1.10 28.15 64.50 5.88 30.75 61.34 coo -1.79 18.29 19.05 -1.19 20.28 19.71 6.90 34.71 68.43 5.56 36.36 68.22 1stc_c02 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 2 hits 1stc_c02 naa= 3 ULMN 3 1thg_c00 LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROLuser 1 3 # 1 217 SER A 30 SER~? 7.32 O1 GOL A 115 354 GLU A 28 GLU~? 9.11 C3 GOL A 115 463 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 48.87 13.74 2.81 48.49 11.54 3.93 15.10 -1.32 71.94 13.61 -0.13 73.45 coo 39.95 14.43 3.01 41.55 14.10 1.63 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 43.90 10.50 2.81 45.63 11.48 3.27 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 1thg_c00 LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROLuser 2 3 # 2 217 SER B 30 SER~? 7.11 O3 AGOL B 114 354 GLU B 28 GLU~? 8.04 O1 BGOL B 114 463 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 48.87 13.74 2.81 48.49 11.54 3.93 1.68 25.09 82.95 3.64 23.84 82.25 coo 39.95 14.43 3.01 41.55 14.10 1.63 7.99 29.80 81.55 8.79 31.72 80.96 coo 43.90 10.50 2.81 45.63 11.48 3.27 5.80 25.06 85.89 7.38 24.42 84.67 1thg_c00 source 1thg LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROL HYDROLASE: 2 hits 1thg_c00 naa= 3 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 A 46 GLU A 89 GLU~? 16.58 CL CL A 114 A 126 LYS A 92 LYS~? 15.91 CL CL A 114 A 171 ALA A 86 ALA~? 8.88 CL CL A 114 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 9.32 -0.83 59.34 13.60 2.28 58.11 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 17.66 -5.25 62.44 18.28 -6.42 63.22 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 2 3 # 2 A 46 GLU B 89 GLU~? 21.63 O3 AGOL B 114 A 126 LYS B 92 LYS~? 22.65 O3 AGOL B 114 A 171 ALA B 86 ALA~? 18.85 O3 AGOL B 114 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 -9.38 32.01 77.42 -10.46 31.89 75.58 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 -7.24 30.82 81.23 -6.80 31.60 82.48 1uf7_c00 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 2 hits 1uf7_c00 naa= 3 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 B 46 GLU A 89 GLU~? 16.58 CL CL A 114 B 126 LYS A 92 LYS~? 15.91 CL CL A 114 B 171 ALA A 86 ALA~? 8.88 CL CL A 114 coo 20.47 87.42 16.54 20.16 87.17 14.45 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 24.73 94.37 14.59 21.08 89.84 11.98 9.32 -0.83 59.34 13.60 2.28 58.11 coo 24.38 86.32 12.71 22.88 86.54 12.71 17.66 -5.25 62.44 18.28 -6.42 63.22 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 2 3 # 2 B 46 GLU B 89 GLU~? 21.63 O3 AGOL B 114 B 126 LYS B 92 LYS~? 22.65 O3 AGOL B 114 B 171 ALA B 86 ALA~? 18.85 O3 AGOL B 114 coo 20.47 87.42 16.54 20.16 87.17 14.45 -9.38 32.01 77.42 -10.46 31.89 75.58 coo 24.73 94.37 14.59 21.08 89.84 11.98 -5.61 30.35 71.49 -11.81 30.46 73.02 coo 24.38 86.32 12.71 22.88 86.54 12.71 -7.24 30.82 81.23 -6.80 31.60 82.48 1uf7_c01 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 2 hits 1uf7_c01 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 27 TYR~? -3.63 C1 GOL A 115s A 317 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 365 ARG A 20 ARG~? 7.91 O3 GOL A 115 coo 1.77 6.56 57.05 3.05 7.44 59.37 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 3.06 2.85 52.79 4.83 3.89 53.24 7.17 5.83 75.53 6.75 7.34 76.93 coo 3.82 17.09 49.56 4.09 14.32 50.84 -2.41 -4.45 73.07 -3.57 -2.63 75.31 ULMN 3 1vzx_c02 2.04.01.0087 user 2 3 # 2 A 314 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 317 GLU A 40 GLU^? -5.26 O1 GOL A 115s A 365 ARG A 25 ARG~? 12.92 C1 GOL A 115 coo 1.77 6.56 57.05 3.05 7.44 59.37 11.79 2.97 71.53 9.83 2.65 69.55 coo 3.06 2.85 52.79 4.83 3.89 53.24 7.17 5.83 75.53 6.75 7.34 76.93 coo 3.82 17.09 49.56 4.09 14.32 50.84 9.84 -9.08 71.15 12.58 -9.77 72.33 ULMN 3 1vzx_c02 2.04.01.0087 user 3 3 # 3 A 314 TYR B 6 TYR^? 13.17 O3 AGOL B 114 A 317 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 365 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 1.77 6.56 57.05 3.05 7.44 59.37 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 3.06 2.85 52.79 4.83 3.89 53.24 2.66 14.38 76.39 3.95 12.75 76.00 coo 3.82 17.09 49.56 4.09 14.32 50.84 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1vzx_c02 2.04.01.0087 user 4 3 # 4 A 314 TYR B 27 TYR~? -3.70 O3 AGOL B 114s A 317 GLU B 40 GLU^? -5.07 O3 BGOL B 114s A 365 ARG B 20 ARG~? 7.55 O1 AGOL B 114 coo 1.77 6.56 57.05 3.05 7.44 59.37 7.36 24.77 79.77 8.81 23.32 81.62 coo 3.06 2.85 52.79 4.83 3.89 53.24 8.17 18.37 77.00 9.28 16.58 76.89 coo 3.82 17.09 49.56 4.09 14.32 50.84 12.50 29.25 70.09 15.28 27.90 70.29 ULMN 3 1vzx_c02 2.04.01.0087 user 5 3 # 5 A 314 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 317 GLU B 66 GLU^? 10.26 O3 BGOL B 114 A 365 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 1.77 6.56 57.05 3.05 7.44 59.37 2.56 21.42 79.08 2.05 22.43 76.53 coo 3.06 2.85 52.79 4.83 3.89 53.24 2.66 14.38 76.39 3.95 12.75 76.00 coo 3.82 17.09 49.56 4.09 14.32 50.84 -8.32 22.59 81.65 -10.97 23.53 80.37 1vzx_c02 source 1vzx 2.04.01.0087 : 5 hits 1vzx_c02 naa= 3 ULMN 3 1vzx_c03 2.04.01.0087 user 1 3 # 1 B1314 TYR A 27 TYR~? -3.63 C1 GOL A 115s B1317 GLU A 40 GLU^? -5.26 O1 GOL A 115s B1365 ARG A 20 ARG~? 7.91 O3 GOL A 115 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 7.17 5.83 75.53 6.75 7.34 76.93 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 -2.41 -4.45 73.07 -3.57 -2.63 75.31 ULMN 3 1vzx_c03 2.04.01.0087 user 2 3 # 2 B1314 TYR A 39 TYR^? 6.40 O1 GOL A 115 B1317 GLU A 40 GLU^? -5.26 O1 GOL A 115s B1365 ARG A 25 ARG~? 12.92 C1 GOL A 115 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 11.79 2.97 71.53 9.83 2.65 69.55 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 7.17 5.83 75.53 6.75 7.34 76.93 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 9.84 -9.08 71.15 12.58 -9.77 72.33 ULMN 3 1vzx_c03 2.04.01.0087 user 3 3 # 3 B1314 TYR B 6 TYR^? 13.17 O3 AGOL B 114 B1317 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B1365 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 2.66 14.38 76.39 3.95 12.75 76.00 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 -8.32 22.59 81.65 -10.97 23.53 80.37 ULMN 3 1vzx_c03 2.04.01.0087 user 4 3 # 4 B1314 TYR B 27 TYR~? -3.70 O3 AGOL B 114s B1317 GLU B 40 GLU^? -5.07 O3 BGOL B 114s B1365 ARG B 20 ARG~? 7.55 O1 AGOL B 114 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 7.36 24.77 79.77 8.81 23.32 81.62 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 8.17 18.37 77.00 9.28 16.58 76.89 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 12.50 29.25 70.09 15.28 27.90 70.29 ULMN 3 1vzx_c03 2.04.01.0087 user 5 3 # 5 B1314 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B1317 GLU B 66 GLU^? 10.26 O3 BGOL B 114 B1365 ARG B 84 ARG~? 19.95 O3 AGOL B 114 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 2.56 21.42 79.08 2.05 22.43 76.53 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 2.66 14.38 76.39 3.95 12.75 76.00 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 -8.32 22.59 81.65 -10.97 23.53 80.37 1vzx_c03 source 1vzx 2.04.01.0087 : 5 hits 1vzx_c03 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 6 TYR^? 13.03 O1 GOL A 115 A 40 ASP A 62 ASP.? 15.17 O2 GOL A 115 A 103 LEU A 7 LEU^? 15.37 O1 GOL A 115 coo 12.09 16.13 10.57 11.28 18.80 10.73 9.35 7.19 64.40 12.10 6.95 63.91 coo 7.55 25.51 14.34 9.65 25.73 14.24 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 11.83 18.73 16.99 10.99 19.71 15.26 2.85 9.63 63.12 2.25 11.51 64.04 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 40 ASP A 32 ASP.? 10.78 CL CL A 114 A 103 LEU A 36 LEU.? 11.72 CL CL A 114 coo 12.09 16.13 10.57 11.28 18.80 10.73 11.79 2.97 71.53 9.83 2.65 69.55 coo 7.55 25.51 14.34 9.65 25.73 14.24 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 11.83 18.73 16.99 10.99 19.71 15.26 18.78 3.65 71.34 16.69 4.00 70.84 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR A 78 TYR~? 10.44 CL CL A 114 A 40 ASP A 32 ASP.? 10.78 CL CL A 114 A 103 LEU A 36 LEU.? 11.72 CL CL A 114 coo 12.09 16.13 10.57 11.28 18.80 10.73 20.68 4.89 66.65 17.95 4.78 66.23 coo 7.55 25.51 14.34 9.65 25.73 14.24 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 11.83 18.73 16.99 10.99 19.71 15.26 18.78 3.65 71.34 16.69 4.00 70.84 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR B 6 TYR^? 13.17 O3 AGOL B 114 A 40 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 103 LEU B 7 LEU^? 15.26 O2 AGOL B 114 coo 12.09 16.13 10.57 11.28 18.80 10.73 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 7.55 25.51 14.34 9.65 25.73 14.24 4.69 24.83 64.29 4.38 25.55 62.31 coo 11.83 18.73 16.99 10.99 19.71 15.26 0.09 17.58 65.96 0.89 15.60 65.66 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 5 3 # 5 A 16 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 40 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 103 LEU B 36 LEU.? 11.87 O3 AGOL B 114 coo 12.09 16.13 10.57 11.28 18.80 10.73 2.56 21.42 79.08 2.05 22.43 76.53 coo 7.55 25.51 14.34 9.65 25.73 14.24 0.49 28.13 88.01 2.42 28.83 88.55 coo 11.83 18.73 16.99 10.99 19.71 15.26 -1.76 20.16 84.59 -0.85 20.20 82.65 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 6 3 # 6 A 16 TYR B 78 TYR~? 15.72 O3 AGOL B 114 A 40 ASP B 32 ASP.? 14.27 O1 BGOL B 114 A 103 LEU B 36 LEU.? 11.87 O3 AGOL B 114 coo 12.09 16.13 10.57 11.28 18.80 10.73 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 7.55 25.51 14.34 9.65 25.73 14.24 0.49 28.13 88.01 2.42 28.83 88.55 coo 11.83 18.73 16.99 10.99 19.71 15.26 -1.76 20.16 84.59 -0.85 20.20 82.65 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 6 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 6 TYR^? 13.03 O1 GOL A 115 B 40 ASP A 62 ASP.? 15.17 O2 GOL A 115 B 103 LEU A 7 LEU^? 15.37 O1 GOL A 115 coo 14.25 20.09 37.35 13.48 17.40 37.38 9.35 7.19 64.40 12.10 6.95 63.91 coo 9.39 10.77 34.53 11.50 10.63 34.41 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 12.89 17.60 31.13 12.34 16.51 32.90 2.85 9.63 63.12 2.25 11.51 64.04 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 40 ASP A 32 ASP.? 10.78 CL CL A 114 B 103 LEU A 36 LEU.? 11.72 CL CL A 114 coo 14.25 20.09 37.35 13.48 17.40 37.38 11.79 2.97 71.53 9.83 2.65 69.55 coo 9.39 10.77 34.53 11.50 10.63 34.41 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 12.89 17.60 31.13 12.34 16.51 32.90 18.78 3.65 71.34 16.69 4.00 70.84 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR A 78 TYR~? 10.44 CL CL A 114 B 40 ASP A 32 ASP.? 10.78 CL CL A 114 B 103 LEU A 36 LEU.? 11.72 CL CL A 114 coo 14.25 20.09 37.35 13.48 17.40 37.38 20.68 4.89 66.65 17.95 4.78 66.23 coo 9.39 10.77 34.53 11.50 10.63 34.41 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 12.89 17.60 31.13 12.34 16.51 32.90 18.78 3.65 71.34 16.69 4.00 70.84 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR B 6 TYR^? 13.17 O3 AGOL B 114 B 40 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 103 LEU B 7 LEU^? 15.26 O2 AGOL B 114 coo 14.25 20.09 37.35 13.48 17.40 37.38 -2.31 18.55 72.58 -4.15 18.18 74.66 coo 9.39 10.77 34.53 11.50 10.63 34.41 4.69 24.83 64.29 4.38 25.55 62.31 coo 12.89 17.60 31.13 12.34 16.51 32.90 0.09 17.58 65.96 0.89 15.60 65.66 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 5 3 # 5 B 16 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 40 ASP B 32 ASP.? 14.27 O1 BGOL B 114 B 103 LEU B 36 LEU.? 11.87 O3 AGOL B 114 coo 14.25 20.09 37.35 13.48 17.40 37.38 2.56 21.42 79.08 2.05 22.43 76.53 coo 9.39 10.77 34.53 11.50 10.63 34.41 0.49 28.13 88.01 2.42 28.83 88.55 coo 12.89 17.60 31.13 12.34 16.51 32.90 -1.76 20.16 84.59 -0.85 20.20 82.65 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 6 3 # 6 B 16 TYR B 78 TYR~? 15.72 O3 AGOL B 114 B 40 ASP B 32 ASP.? 14.27 O1 BGOL B 114 B 103 LEU B 36 LEU.? 11.87 O3 AGOL B 114 coo 14.25 20.09 37.35 13.48 17.40 37.38 -6.72 19.79 83.49 -5.56 20.39 81.01 coo 9.39 10.77 34.53 11.50 10.63 34.41 0.49 28.13 88.01 2.42 28.83 88.55 coo 12.89 17.60 31.13 12.34 16.51 32.90 -1.76 20.16 84.59 -0.85 20.20 82.65 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 6 hits 1vzz_c01 naa= 3 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 1 3 # 1 A 105 HIS A 60 HIS.? 17.72 O2 GOL A 115 A 169 ASP A 16 ASP~? 16.03 O2 GOL A 115 A 288 GLU A 17 GLU~? 11.95 O3 GOL A 115 coo 67.72 35.99 30.87 69.77 36.13 31.33 -6.29 5.83 61.74 -6.55 4.46 63.31 coo 73.17 30.66 22.56 72.87 30.30 20.46 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 74.06 28.51 15.92 73.77 29.56 17.73 -5.33 -8.56 70.68 -3.96 -7.90 72.21 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 2 3 # 2 A 105 HIS B 60 HIS.? 17.24 O2 AGOL B 114 A 169 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 288 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo 67.72 35.99 30.87 69.77 36.13 31.33 4.96 22.92 58.66 6.72 23.67 59.53 coo 73.17 30.66 22.56 72.87 30.30 20.46 9.86 30.83 63.58 9.25 29.72 61.91 coo 74.06 28.51 15.92 73.77 29.56 17.73 11.50 35.87 67.45 13.35 35.01 67.92 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 2 hits 1w1o_c00 naa= 3 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 1 3 # 1 A 243 THR A 93 THR~? 19.76 CL CL A 114 A 345 PHE A 19 PHE~? 11.77 O2 GOL A 115 A 352 CYH A 23 CYH~? 8.53 O2 GOL A 115 coo 9.58 21.79 21.50 11.25 23.03 20.90 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 19.40 19.75 18.58 17.39 17.81 18.80 -0.32 -2.33 65.65 0.86 0.17 65.52 coo 21.57 22.52 22.79 19.20 21.13 23.26 4.86 -2.67 69.49 3.11 -0.86 68.28 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 2 3 # 2 A 243 THR A 103 THR^? 8.58 O2 AGOL B 114 A 345 PHE A 69 PHE^? 14.10 CL CL A 114 A 352 CYH A 67 CYH^? 10.62 O1 GOL A 115 coo 9.58 21.79 21.50 11.25 23.03 20.90 12.04 17.93 67.84 10.77 16.56 68.93 coo 19.40 19.75 18.58 17.39 17.81 18.80 19.40 9.34 69.57 17.76 7.83 67.92 coo 21.57 22.52 22.79 19.20 21.13 23.26 13.60 7.87 70.43 13.69 6.07 68.33 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 3 3 # 3 A 243 THR B 77 THR~? 22.17 O3 AGOL B 114 A 345 PHE B 69 PHE^? 14.96 O3 BGOL B 114 A 352 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 9.58 21.79 21.50 11.25 23.03 20.90 -10.01 18.85 88.65 -8.96 18.82 90.53 coo 19.40 19.75 18.58 17.39 17.81 18.80 -4.08 14.97 83.14 -4.34 16.94 81.21 coo 21.57 22.52 22.79 19.20 21.13 23.26 0.03 16.72 79.11 -1.50 18.92 78.46 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 4 3 # 4 A 243 THR B 103 THR^? 8.74 O2 GOL A 115 A 345 PHE B 69 PHE^? 14.96 O3 BGOL B 114 A 352 CYH B 67 CYH^? 10.77 O3 AGOL B 114 coo 9.58 21.79 21.50 11.25 23.03 20.90 -2.26 7.65 74.38 -0.48 8.88 74.34 coo 19.40 19.75 18.58 17.39 17.81 18.80 -4.08 14.97 83.14 -4.34 16.94 81.21 coo 21.57 22.52 22.79 19.20 21.13 23.26 0.03 16.72 79.11 -1.50 18.92 78.46 1xqd_c02 source 1xqd CYTOCHROME P450 55A1 : 4 hits 1xqd_c02 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 21 ALA~? 11.17 O3 GOL A 115 B 126 ARG A 25 ARG~? 12.92 C1 GOL A 115 B 138 GLU A 17 GLU~? 11.95 O3 GOL A 115 coo 2.11 4.00 19.31 3.14 4.86 19.99 2.19 -7.22 70.54 1.78 -8.67 70.28 coo 2.45 5.53 11.28 3.59 7.56 13.29 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 6.10 2.00 25.24 6.12 1.84 23.13 -5.33 -8.56 70.68 -3.96 -7.90 72.21 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 45 ALA^? 11.44 O2 GOL A 115 B 126 ARG A 42 ARG^? 5.53 O2 GOL A 115 B 138 GLU A 46 GLU^? 17.99 O2 GOL A 115 coo 2.11 4.00 19.31 3.14 4.86 19.99 -6.43 5.27 72.35 -6.42 5.31 73.89 coo 2.45 5.53 11.28 3.59 7.56 13.29 2.91 6.62 75.93 0.97 5.83 78.22 coo 6.10 2.00 25.24 6.12 1.84 23.13 -10.58 9.40 72.08 -11.31 10.55 73.74 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 B 124 ALA B 21 ALA~? 11.18 O1 AGOL B 114 B 126 ARG B 25 ARG~? 13.22 O1 BGOL B 114 B 138 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo 2.11 4.00 19.31 3.14 4.86 19.99 8.31 32.49 72.77 8.50 34.05 72.50 coo 2.45 5.53 11.28 3.59 7.56 13.29 3.18 34.46 77.89 5.47 36.12 76.56 coo 6.10 2.00 25.24 6.12 1.84 23.13 11.50 35.87 67.45 13.35 35.01 67.92 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 B 124 ALA B 45 ALA^? 11.50 O2 AGOL B 114 B 126 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 138 GLU B 46 GLU^? 18.15 O2 AGOL B 114 coo 2.11 4.00 19.31 3.14 4.86 19.99 12.95 21.14 63.86 14.23 20.76 64.58 coo 2.45 5.53 11.28 3.59 7.56 13.29 10.15 17.42 72.76 8.76 14.87 71.71 coo 6.10 2.00 25.24 6.12 1.84 23.13 14.18 17.59 59.29 15.88 16.34 59.02 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 B 124 ALA B 104 ALA^? 7.64 O2 GOL A 115 B 126 ARG A 20 ARG~? 7.91 O3 GOL A 115 B 138 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 2.11 4.00 19.31 3.14 4.86 19.99 -2.07 4.32 76.12 -3.28 3.38 75.81 coo 2.45 5.53 11.28 3.59 7.56 13.29 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo 6.10 2.00 25.24 6.12 1.84 23.13 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 B 124 ALA B 104 ALA^? 7.64 O2 GOL A 115 B 126 ARG B 102 ARG^? 14.15 O2 GOL A 115 B 138 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 2.11 4.00 19.31 3.14 4.86 19.99 -2.07 4.32 76.12 -3.28 3.38 75.81 coo 2.45 5.53 11.28 3.59 7.56 13.29 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 6.10 2.00 25.24 6.12 1.84 23.13 7.17 5.83 75.53 6.75 7.34 76.93 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 21 ALA~? 11.17 O3 GOL A 115 C 126 ARG A 25 ARG~? 12.92 C1 GOL A 115 C 138 GLU A 17 GLU~? 11.95 O3 GOL A 115 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 2.19 -7.22 70.54 1.78 -8.67 70.28 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 9.84 -9.08 71.15 12.58 -9.77 72.33 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -5.33 -8.56 70.68 -3.96 -7.90 72.21 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 45 ALA^? 11.44 O2 GOL A 115 C 126 ARG A 42 ARG^? 5.53 O2 GOL A 115 C 138 GLU A 46 GLU^? 17.99 O2 GOL A 115 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -6.43 5.27 72.35 -6.42 5.31 73.89 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 2.91 6.62 75.93 0.97 5.83 78.22 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -10.58 9.40 72.08 -11.31 10.55 73.74 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA B 21 ALA~? 11.18 O1 AGOL B 114 C 126 ARG B 25 ARG~? 13.22 O1 BGOL B 114 C 138 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 8.31 32.49 72.77 8.50 34.05 72.50 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 3.18 34.46 77.89 5.47 36.12 76.56 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 11.50 35.87 67.45 13.35 35.01 67.92 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 C 124 ALA B 45 ALA^? 11.50 O2 AGOL B 114 C 126 ARG B 42 ARG^? 8.41 O2 AGOL B 114 C 138 GLU B 46 GLU^? 18.15 O2 AGOL B 114 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 12.95 21.14 63.86 14.23 20.76 64.58 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 10.15 17.42 72.76 8.76 14.87 71.71 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 14.18 17.59 59.29 15.88 16.34 59.02 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 4 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 21 ALA~? 11.17 O3 GOL A 115 D 126 ARG A 25 ARG~? 12.92 C1 GOL A 115 D 138 GLU A 17 GLU~? 11.95 O3 GOL A 115 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 2.19 -7.22 70.54 1.78 -8.67 70.28 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 6.23 0.50 57.10 5.93 0.72 59.19 -5.33 -8.56 70.68 -3.96 -7.90 72.21 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 45 ALA^? 11.44 O2 GOL A 115 D 126 ARG A 42 ARG^? 5.53 O2 GOL A 115 D 138 GLU A 46 GLU^? 17.99 O2 GOL A 115 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -6.43 5.27 72.35 -6.42 5.31 73.89 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 2.91 6.62 75.93 0.97 5.83 78.22 coo 6.23 0.50 57.10 5.93 0.72 59.19 -10.58 9.40 72.08 -11.31 10.55 73.74 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA B 21 ALA~? 11.18 O1 AGOL B 114 D 126 ARG B 25 ARG~? 13.22 O1 BGOL B 114 D 138 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 8.31 32.49 72.77 8.50 34.05 72.50 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 3.18 34.46 77.89 5.47 36.12 76.56 coo 6.23 0.50 57.10 5.93 0.72 59.19 11.50 35.87 67.45 13.35 35.01 67.92 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 D 124 ALA B 45 ALA^? 11.50 O2 AGOL B 114 D 126 ARG B 42 ARG^? 8.41 O2 AGOL B 114 D 138 GLU B 46 GLU^? 18.15 O2 AGOL B 114 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 12.95 21.14 63.86 14.23 20.76 64.58 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 10.15 17.42 72.76 8.76 14.87 71.71 coo 6.23 0.50 57.10 5.93 0.72 59.19 14.18 17.59 59.29 15.88 16.34 59.02 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 D 124 ALA B 104 ALA^? 7.64 O2 GOL A 115 D 126 ARG A 20 ARG~? 7.91 O3 GOL A 115 D 138 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -2.07 4.32 76.12 -3.28 3.38 75.81 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo 6.23 0.50 57.10 5.93 0.72 59.19 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 D 124 ALA B 104 ALA^? 7.64 O2 GOL A 115 D 126 ARG B 102 ARG^? 14.15 O2 GOL A 115 D 138 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -2.07 4.32 76.12 -3.28 3.38 75.81 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -7.93 9.11 76.54 -9.19 6.36 75.80 coo 6.23 0.50 57.10 5.93 0.72 59.19 7.17 5.83 75.53 6.75 7.34 76.93 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 21 ALA~? 11.17 O3 GOL A 115 E 126 ARG A 25 ARG~? 12.92 C1 GOL A 115 E 138 GLU A 17 GLU~? 11.95 O3 GOL A 115 coo -4.56 10.03 62.36 -4.38 11.31 61.55 2.19 -7.22 70.54 1.78 -8.67 70.28 coo -3.02 12.00 70.07 -1.94 13.84 67.82 9.84 -9.08 71.15 12.58 -9.77 72.33 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -5.33 -8.56 70.68 -3.96 -7.90 72.21 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 45 ALA^? 11.44 O2 GOL A 115 E 126 ARG A 42 ARG^? 5.53 O2 GOL A 115 E 138 GLU A 46 GLU^? 17.99 O2 GOL A 115 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -6.43 5.27 72.35 -6.42 5.31 73.89 coo -3.02 12.00 70.07 -1.94 13.84 67.82 2.91 6.62 75.93 0.97 5.83 78.22 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -10.58 9.40 72.08 -11.31 10.55 73.74 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA B 21 ALA~? 11.18 O1 AGOL B 114 E 126 ARG B 25 ARG~? 13.22 O1 BGOL B 114 E 138 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo -4.56 10.03 62.36 -4.38 11.31 61.55 8.31 32.49 72.77 8.50 34.05 72.50 coo -3.02 12.00 70.07 -1.94 13.84 67.82 3.18 34.46 77.89 5.47 36.12 76.56 coo -8.67 12.22 56.54 -8.68 12.09 58.65 11.50 35.87 67.45 13.35 35.01 67.92 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 E 124 ALA B 45 ALA^? 11.50 O2 AGOL B 114 E 126 ARG B 42 ARG^? 8.41 O2 AGOL B 114 E 138 GLU B 46 GLU^? 18.15 O2 AGOL B 114 coo -4.56 10.03 62.36 -4.38 11.31 61.55 12.95 21.14 63.86 14.23 20.76 64.58 coo -3.02 12.00 70.07 -1.94 13.84 67.82 10.15 17.42 72.76 8.76 14.87 71.71 coo -8.67 12.22 56.54 -8.68 12.09 58.65 14.18 17.59 59.29 15.88 16.34 59.02 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 E 124 ALA B 104 ALA^? 7.64 O2 GOL A 115 E 126 ARG A 20 ARG~? 7.91 O3 GOL A 115 E 138 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo -4.56 10.03 62.36 -4.38 11.31 61.55 -2.07 4.32 76.12 -3.28 3.38 75.81 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -2.41 -4.45 73.07 -3.57 -2.63 75.31 coo -8.67 12.22 56.54 -8.68 12.09 58.65 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 E 124 ALA B 104 ALA^? 7.64 O2 GOL A 115 E 126 ARG B 102 ARG^? 14.15 O2 GOL A 115 E 138 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo -4.56 10.03 62.36 -4.38 11.31 61.55 -2.07 4.32 76.12 -3.28 3.38 75.81 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -7.93 9.11 76.54 -9.19 6.36 75.80 coo -8.67 12.22 56.54 -8.68 12.09 58.65 7.17 5.83 75.53 6.75 7.34 76.93 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 21 ALA~? 11.17 O3 GOL A 115 F 126 ARG A 25 ARG~? 12.92 C1 GOL A 115 F 138 GLU A 17 GLU~? 11.95 O3 GOL A 115 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 2.19 -7.22 70.54 1.78 -8.67 70.28 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 9.84 -9.08 71.15 12.58 -9.77 72.33 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -5.33 -8.56 70.68 -3.96 -7.90 72.21 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 45 ALA^? 11.44 O2 GOL A 115 F 126 ARG A 42 ARG^? 5.53 O2 GOL A 115 F 138 GLU A 46 GLU^? 17.99 O2 GOL A 115 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -6.43 5.27 72.35 -6.42 5.31 73.89 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 2.91 6.62 75.93 0.97 5.83 78.22 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -10.58 9.40 72.08 -11.31 10.55 73.74 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA B 21 ALA~? 11.18 O1 AGOL B 114 F 126 ARG B 25 ARG~? 13.22 O1 BGOL B 114 F 138 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 8.31 32.49 72.77 8.50 34.05 72.50 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 3.18 34.46 77.89 5.47 36.12 76.56 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 11.50 35.87 67.45 13.35 35.01 67.92 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 F 124 ALA B 45 ALA^? 11.50 O2 AGOL B 114 F 126 ARG B 42 ARG^? 8.41 O2 AGOL B 114 F 138 GLU B 46 GLU^? 18.15 O2 AGOL B 114 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 12.95 21.14 63.86 14.23 20.76 64.58 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 10.15 17.42 72.76 8.76 14.87 71.71 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 14.18 17.59 59.29 15.88 16.34 59.02 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 4 hits 1xs1_c11 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY A 65 GLY^? 7.74 O1 GOL A 115 B 175 ARG A 42 ARG^? 5.53 O2 GOL A 115 B 242 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 99.45 58.28 3.33 99.57 58.61 4.10 7.16 5.92 68.88 6.95 6.74 68.72 coo 106.37 63.53 0.89 108.02 63.40 -1.62 2.91 6.62 75.93 0.97 5.83 78.22 coo 100.93 69.04 4.38 99.52 68.48 2.09 9.34 -1.01 75.16 10.26 -0.19 77.66 1xva_c03 source 1xva GLYCINE N-METHYLTRANSFERASE : 1 hits 1xva_c03 naa= 3 ULMN 3 1ybv_c00 TRIHYDROXYNAPHTHALENE REDUCTASE user 1 3 # 1 A 164 SER A 81 SER~? -3.02 CL CL A 114s A 178 TYR A 78 TYR~? 10.44 CL CL A 114 A 182 LYS A 85 LYS~? 9.11 CL CL A 114 coo 81.46 10.53 21.66 82.20 10.82 19.39 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 87.67 8.69 17.10 86.62 10.83 18.52 20.68 4.89 66.65 17.95 4.78 66.23 coo 85.30 6.17 22.83 87.26 11.02 23.50 19.43 -1.95 61.52 24.42 -0.23 58.09 1ybv_c00 source 1ybv TRIHYDROXYNAPHTHALENE REDUCTASE : 1 hits 1ybv_c00 naa= 3 ULMN 3 1ybv_c01 TRIHYDROXYNAPHTHALENE REDUCTASE user 1 3 # 1 B 164 SER A 81 SER~? -3.02 CL CL A 114s B 178 TYR A 78 TYR~? 10.44 CL CL A 114 B 182 LYS A 85 LYS~? 9.11 CL CL A 114 coo 61.22 3.61 34.51 60.46 1.86 35.98 24.92 -0.43 64.22 23.66 -1.27 66.14 coo 54.99 -1.20 35.40 56.04 1.15 36.44 20.68 4.89 66.65 17.95 4.78 66.23 coo 57.40 2.23 30.19 55.43 5.44 33.87 19.43 -1.95 61.52 24.42 -0.23 58.09 1ybv_c01 source 1ybv TRIHYDROXYNAPHTHALENE REDUCTASE : 1 hits 1ybv_c01 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 87 TRP~? 11.00 O1 GOL A 115 223 ASP A 32 ASP.? 10.78 CL CL A 114 258 ALA A 80 ALA~? 7.61 CL CL A 114 coo 128.40 33.01 26.67 128.12 36.28 28.81 14.09 -2.53 67.71 14.42 1.36 68.01 coo 127.91 41.73 23.55 129.18 40.35 24.44 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 141.00 37.49 25.74 139.80 37.53 24.78 26.29 2.47 62.14 27.72 2.90 62.50 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP B 87 TRP~? 10.98 O3 AGOL B 114 223 ASP B 32 ASP.? 14.27 O1 BGOL B 114 258 ALA B 80 ALA~? 24.66 O3 AGOL B 114 coo 128.40 33.01 26.67 128.12 36.28 28.81 -1.46 27.41 80.24 -1.42 23.56 79.72 coo 127.91 41.73 23.55 129.18 40.35 24.44 0.49 28.13 88.01 2.42 28.83 88.55 coo 141.00 37.49 25.74 139.80 37.53 24.78 -13.28 22.08 86.19 -13.85 21.40 87.46 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 2 hits 2aat_c01 naa= 3 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 1 3 # 1 200 SER A 30 SER~? 7.32 O1 GOL A 115 327 GLU A 28 GLU~? 9.11 C3 GOL A 115 440 HIS A 31 HIS~? 8.53 C1 GOL A 115 coo 6.96 64.04 57.84 6.74 63.69 60.26 15.10 -1.32 71.94 13.61 -0.13 73.45 coo 14.82 64.63 62.37 13.47 65.72 61.17 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 9.52 66.51 63.07 8.75 65.02 61.81 15.30 -2.41 76.92 13.57 -1.61 77.79 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 2 3 # 2 200 SER B 30 SER~? 7.11 O3 AGOL B 114 327 GLU B 28 GLU~? 8.04 O1 BGOL B 114 440 HIS B 31 HIS~? 8.39 O3 AGOL B 114 coo 6.96 64.04 57.84 6.74 63.69 60.26 1.68 25.09 82.95 3.64 23.84 82.25 coo 14.82 64.63 62.37 13.47 65.72 61.17 7.99 29.80 81.55 8.79 31.72 80.96 coo 9.52 66.51 63.07 8.75 65.02 61.81 5.80 25.06 85.89 7.38 24.42 84.67 2ace_c00 source 2ace ACETYLCHOLINESTERASE : 2 hits 2ace_c00 naa= 3 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 50 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 10.15 10.32 71.63 9.22 11.91 72.68 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.06 3.47 61.87 11.73 2.73 62.95 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 50 GLU A 89 GLU~? 16.58 CL CL A 114 B 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.06 3.47 61.87 11.73 2.73 62.95 2ag0_c04 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c04 naa= 3 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 50 GLU A 66 GLU^? 10.35 O1 GOL A 115 B 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 10.15 10.32 71.63 9.22 11.91 72.68 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.06 3.47 61.87 11.73 2.73 62.95 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 50 GLU A 89 GLU~? 16.58 CL CL A 114 B 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.06 3.47 61.87 11.73 2.73 62.95 2ag0_c08 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c08 naa= 3 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 1 3 # 1 A 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 50 GLU A 66 GLU^? 10.35 O1 GOL A 115 A 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 10.15 10.32 71.63 9.22 11.91 72.68 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 10.06 3.47 61.87 11.73 2.73 62.95 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 2 3 # 2 A 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 50 GLU A 89 GLU~? 16.58 CL CL A 114 A 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 10.06 3.47 61.87 11.73 2.73 62.95 2ag0_c09 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c09 naa= 3 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 1 3 # 1 C 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 C 50 GLU A 66 GLU^? 10.35 O1 GOL A 115 C 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 74.92 8.52 28.42 74.88 6.86 29.70 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 65.25 15.95 28.73 65.73 15.63 30.78 10.15 10.32 71.63 9.22 11.91 72.68 coo 70.80 6.73 32.72 71.88 8.55 32.53 10.06 3.47 61.87 11.73 2.73 62.95 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 2 3 # 2 C 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 C 50 GLU A 89 GLU~? 16.58 CL CL A 114 C 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 74.92 8.52 28.42 74.88 6.86 29.70 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 65.25 15.95 28.73 65.73 15.63 30.78 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 70.80 6.73 32.72 71.88 8.55 32.53 10.06 3.47 61.87 11.73 2.73 62.95 2ag0_c10 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c10 naa= 3 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 1 3 # 1 D 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 D 50 GLU A 66 GLU^? 10.35 O1 GOL A 115 D 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 38.66 11.31 27.15 38.67 12.13 25.22 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 48.72 12.85 33.83 48.36 14.77 32.95 10.15 10.32 71.63 9.22 11.91 72.68 coo 42.85 14.77 24.15 41.85 15.11 26.02 10.06 3.47 61.87 11.73 2.73 62.95 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 2 3 # 2 D 29 HIS A 26 HIS~? 10.00 O1 GOL A 115 D 50 GLU A 89 GLU~? 16.58 CL CL A 114 D 113 GLN A 97 GLN.? 13.57 O1 GOL A 115 coo 38.66 11.31 27.15 38.67 12.13 25.22 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 48.72 12.85 33.83 48.36 14.77 32.95 13.52 -6.00 58.57 12.62 -5.23 56.79 coo 42.85 14.77 24.15 41.85 15.11 26.02 10.06 3.47 61.87 11.73 2.73 62.95 2ag0_c11 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c11 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 16 ASP~? 16.03 O2 GOL A 115 231 ASP B 72 ASP~? 17.82 O3 GOL A 115 294 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo 27.89 102.52 14.98 29.35 101.92 13.57 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 14.74 93.05 -1.00 14.30 94.22 0.73 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 33.16 106.80 7.72 33.34 104.87 6.92 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP A 62 ASP.? 15.17 O2 GOL A 115 231 ASP A 32 ASP.? 10.78 CL CL A 114 294 ASP A 16 ASP~? 16.03 O2 GOL A 115 coo 27.89 102.52 14.98 29.35 101.92 13.57 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 14.74 93.05 -1.00 14.30 94.22 0.73 19.63 -5.14 72.66 19.01 -6.45 74.22 coo 33.16 106.80 7.72 33.34 104.87 6.92 -6.36 -4.07 67.12 -7.21 -2.58 65.89 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP A 62 ASP.? 15.17 O2 GOL A 115 231 ASP B 72 ASP~? 17.82 O3 GOL A 115 294 ASP A 16 ASP~? 16.03 O2 GOL A 115 coo 27.89 102.52 14.98 29.35 101.92 13.57 -2.26 2.59 64.84 -3.73 2.30 63.39 coo 14.74 93.05 -1.00 14.30 94.22 0.73 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 33.16 106.80 7.72 33.34 104.87 6.92 -6.36 -4.07 67.12 -7.21 -2.58 65.89 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 # 4 193 ASP B 16 ASP~? 15.56 O2 BGOL B 114 231 ASP A 72 ASP~? 17.54 O2 AGOL B 114 294 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 27.89 102.52 14.98 29.35 101.92 13.57 9.86 30.83 63.58 9.25 29.72 61.91 coo 14.74 93.05 -1.00 14.30 94.22 0.73 26.30 14.43 67.36 25.07 16.12 67.01 coo 33.16 106.80 7.72 33.34 104.87 6.92 4.69 24.83 64.29 4.38 25.55 62.31 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 5 3 # 5 193 ASP B 62 ASP.? 15.08 O2 BGOL B 114 231 ASP A 72 ASP~? 17.54 O2 AGOL B 114 294 ASP B 16 ASP~? 15.56 O2 BGOL B 114 coo 27.89 102.52 14.98 29.35 101.92 13.57 4.69 24.83 64.29 4.38 25.55 62.31 coo 14.74 93.05 -1.00 14.30 94.22 0.73 26.30 14.43 67.36 25.07 16.12 67.01 coo 33.16 106.80 7.72 33.34 104.87 6.92 9.86 30.83 63.58 9.25 29.72 61.91 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 6 3 # 6 193 ASP B 62 ASP.? 15.08 O2 BGOL B 114 231 ASP B 32 ASP.? 14.27 O1 BGOL B 114 294 ASP B 16 ASP~? 15.56 O2 BGOL B 114 coo 27.89 102.52 14.98 29.35 101.92 13.57 4.69 24.83 64.29 4.38 25.55 62.31 coo 14.74 93.05 -1.00 14.30 94.22 0.73 0.49 28.13 88.01 2.42 28.83 88.55 coo 33.16 106.80 7.72 33.34 104.87 6.92 9.86 30.83 63.58 9.25 29.72 61.91 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 6 hits 2amg_c06 naa= 3 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 3 # 1 35 ASP B 16 ASP~? 15.56 O2 BGOL B 114 38 SER B 15 SER~? 17.11 O1 AGOL B 114 218 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo 41.14 58.72 105.19 42.39 59.85 103.92 9.86 30.83 63.58 9.25 29.72 61.91 coo 46.04 57.35 103.96 44.97 58.52 105.78 6.70 34.48 63.20 7.42 36.00 64.96 coo 41.33 60.20 97.63 42.00 60.96 99.49 4.69 24.83 64.29 4.38 25.55 62.31 2apr_c04 source 2apr ACID PROTEINASE (RHIZOPUSPEPSIN) (E.C.3.4.23.6: 1 hits 2apr_c04 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 161 ASP B 71 ASP~? 19.48 O2 GOL A 115 A 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 2.91 6.62 75.93 0.97 5.83 78.22 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 161 ASP B 72 ASP~? 17.82 O3 GOL A 115 A 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 2.91 6.62 75.93 0.97 5.83 78.22 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 3 3 # 3 A 14 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 161 ASP A 71 ASP~? 16.51 CL CL A 114 A 174 TYR A 75 TYR~? 14.24 CL CL A 114 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 10.15 17.42 72.76 8.76 14.87 71.71 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 25.70 13.65 72.38 26.87 11.94 72.89 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 21.81 10.09 65.59 20.00 9.75 63.52 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 4 3 # 4 A 14 ARG B 42 ARG^? 8.41 O2 AGOL B 114 A 161 ASP A 72 ASP~? 17.54 O2 AGOL B 114 A 174 TYR A 75 TYR~? 14.24 CL CL A 114 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 10.15 17.42 72.76 8.76 14.87 71.71 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 26.30 14.43 67.36 25.07 16.12 67.01 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 21.81 10.09 65.59 20.00 9.75 63.52 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 4 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 42 ARG^? 5.53 O2 GOL A 115 B 161 ASP B 71 ASP~? 19.48 O2 GOL A 115 B 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 2.91 6.62 75.93 0.97 5.83 78.22 coo -14.86 10.19 8.14 -14.82 12.31 8.42 -5.76 9.33 88.77 -5.88 10.77 90.36 coo -21.46 12.70 8.53 -19.04 12.30 7.24 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG A 42 ARG^? 5.53 O2 GOL A 115 B 161 ASP B 72 ASP~? 17.82 O3 GOL A 115 B 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 2.91 6.62 75.93 0.97 5.83 78.22 coo -14.86 10.19 8.14 -14.82 12.31 8.42 -10.25 9.55 86.42 -10.16 8.13 84.85 coo -21.46 12.70 8.53 -19.04 12.30 7.24 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 3 3 # 3 B 14 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 161 ASP A 71 ASP~? 16.51 CL CL A 114 B 174 TYR A 75 TYR~? 14.24 CL CL A 114 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 10.15 17.42 72.76 8.76 14.87 71.71 coo -14.86 10.19 8.14 -14.82 12.31 8.42 25.70 13.65 72.38 26.87 11.94 72.89 coo -21.46 12.70 8.53 -19.04 12.30 7.24 21.81 10.09 65.59 20.00 9.75 63.52 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 4 3 # 4 B 14 ARG B 42 ARG^? 8.41 O2 AGOL B 114 B 161 ASP A 72 ASP~? 17.54 O2 AGOL B 114 B 174 TYR A 75 TYR~? 14.24 CL CL A 114 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 10.15 17.42 72.76 8.76 14.87 71.71 coo -14.86 10.19 8.14 -14.82 12.31 8.42 26.30 14.43 67.36 25.07 16.12 67.01 coo -21.46 12.70 8.53 -19.04 12.30 7.24 21.81 10.09 65.59 20.00 9.75 63.52 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 4 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 42 ARG^? 5.53 O2 GOL A 115 C 161 ASP B 71 ASP~? 19.48 O2 GOL A 115 C 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo 2.84 19.43 40.34 1.59 20.35 37.65 2.91 6.62 75.93 0.97 5.83 78.22 coo -0.62 11.10 28.05 -0.65 13.15 27.46 -5.76 9.33 88.77 -5.88 10.77 90.36 coo 5.94 13.28 27.17 3.53 13.05 28.58 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG A 42 ARG^? 5.53 O2 GOL A 115 C 161 ASP B 72 ASP~? 17.82 O3 GOL A 115 C 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo 2.84 19.43 40.34 1.59 20.35 37.65 2.91 6.62 75.93 0.97 5.83 78.22 coo -0.62 11.10 28.05 -0.65 13.15 27.46 -10.25 9.55 86.42 -10.16 8.13 84.85 coo 5.94 13.28 27.17 3.53 13.05 28.58 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 3 3 # 3 C 14 ARG B 42 ARG^? 8.41 O2 AGOL B 114 C 161 ASP A 71 ASP~? 16.51 CL CL A 114 C 174 TYR A 75 TYR~? 14.24 CL CL A 114 coo 2.84 19.43 40.34 1.59 20.35 37.65 10.15 17.42 72.76 8.76 14.87 71.71 coo -0.62 11.10 28.05 -0.65 13.15 27.46 25.70 13.65 72.38 26.87 11.94 72.89 coo 5.94 13.28 27.17 3.53 13.05 28.58 21.81 10.09 65.59 20.00 9.75 63.52 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 42 ARG^? 5.53 O2 GOL A 115 D 161 ASP B 71 ASP~? 19.48 O2 GOL A 115 D 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 2.91 6.62 75.93 0.97 5.83 78.22 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 -5.76 9.33 88.77 -5.88 10.77 90.36 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG A 42 ARG^? 5.53 O2 GOL A 115 D 161 ASP B 72 ASP~? 17.82 O3 GOL A 115 D 174 TYR B 75 TYR~? 19.43 O3 BGOL B 114 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 2.91 6.62 75.93 0.97 5.83 78.22 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 -10.25 9.55 86.42 -10.16 8.13 84.85 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 -8.67 14.69 82.60 -9.45 15.65 80.11 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 3 3 # 3 D 14 ARG B 42 ARG^? 8.41 O2 AGOL B 114 D 161 ASP A 71 ASP~? 16.51 CL CL A 114 D 174 TYR A 75 TYR~? 14.24 CL CL A 114 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 10.15 17.42 72.76 8.76 14.87 71.71 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 25.70 13.65 72.38 26.87 11.94 72.89 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 21.81 10.09 65.59 20.00 9.75 63.52 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c11 naa= 3 ULMN 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 1 3 # 1 65 THR A 93 THR~? 19.76 CL CL A 114 242 CYH A 23 CYH~? 8.53 O2 GOL A 115 270 PHE A 19 PHE~? 11.77 O2 GOL A 115 coo 12.97 28.35 3.84 11.81 28.07 2.09 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 8.65 19.49 -2.27 10.50 20.91 -0.59 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 9.41 24.60 -3.66 7.52 26.57 -4.16 -0.32 -2.33 65.65 0.86 0.17 65.52 ULMN 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 2 3 # 2 65 THR B 93 THR~? 17.37 O3 AGOL B 114 242 CYH B 23 CYH~? 8.19 O2 BGOL B 114 270 PHE B 19 PHE~? 11.52 O2 BGOL B 114 coo 12.97 28.35 3.84 11.81 28.07 2.09 -2.97 33.11 71.20 -2.14 34.67 72.49 coo 8.65 19.49 -2.27 10.50 20.91 -0.59 5.26 28.04 73.57 5.28 26.63 71.09 coo 9.41 24.60 -3.66 7.52 26.57 -4.16 4.89 28.90 67.24 3.84 26.39 67.76 2cnd_c01 source 2cnd NADH-DEPENDENT NITRATE REDUCTASE (CYTOCHROME B: 2 hits 2cnd_c01 naa= 3 ULMN 3 2dw7_c33 BLL6730 PROTEIN user 1 3 # 1 B 182 LYS A 38 LYS^? 8.53 O1 GOL A 115 B 184 LYS A 70 LYS.? 17.56 C1 AGOL B 114 B 345 ASP A 32 ASP.? 10.78 CL CL A 114 coo 38.76 2.27 4.00 34.00 5.99 4.37 15.57 5.57 75.60 11.35 8.72 79.21 coo 40.63 7.13 9.06 35.85 7.36 8.95 22.34 11.58 74.38 24.39 10.91 80.02 coo 34.36 -6.33 13.69 36.02 -6.07 12.41 19.63 -5.14 72.66 19.01 -6.45 74.22 2dw7_c33 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c33 naa= 3 ULMN 3 2f9z_c00 PROTEIN (CHEMOTAXIS METHYLATION PROTuser 1 3 # 1 C 21 THR A 93 THR~? 19.76 CL CL A 114 C 27 CYH A 23 CYH~? 8.53 O2 GOL A 115 C 44 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 31.18 22.40 -15.93 30.94 20.86 -14.44 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 33.52 13.02 -11.58 35.31 14.81 -10.35 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 32.65 18.86 -10.97 34.16 18.23 -12.28 10.26 -5.82 64.75 8.54 -6.13 65.90 2f9z_c00 source 2f9z PROTEIN (CHEMOTAXIS METHYLATION PROTEIN) : 1 hits 2f9z_c00 naa= 3 ULMN 3 2f9z_c01 PROTEIN (CHEMOTAXIS METHYLATION PROTuser 1 3 # 1 D 21 THR A 93 THR~? 19.76 CL CL A 114 D 27 CYH A 23 CYH~? 8.53 O2 GOL A 115 D 44 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 8.10 8.69 -37.60 9.58 7.79 -38.92 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 15.06 1.75 -41.51 12.66 0.75 -42.59 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 10.53 5.51 -42.28 10.30 3.78 -41.11 10.26 -5.82 64.75 8.54 -6.13 65.90 2f9z_c01 source 2f9z PROTEIN (CHEMOTAXIS METHYLATION PROTEIN) : 1 hits 2f9z_c01 naa= 3 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 150 TYR A 75 TYR~? 14.24 CL CL A 114 A 245 ASP A 71 ASP~? 16.51 CL CL A 114 A 273 LYS A 38 LYS^? 8.53 O1 GOL A 115 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 21.81 10.09 65.59 20.00 9.75 63.52 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 25.70 13.65 72.38 26.87 11.94 72.89 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 15.57 5.57 75.60 11.35 8.72 79.21 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 150 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 245 ASP B 71 ASP~? 19.48 O2 GOL A 115 A 273 LYS B 38 LYS^? 6.81 O3 BGOL B 114 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 -5.76 9.33 88.77 -5.88 10.77 90.36 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 3.47 17.87 83.94 8.53 16.31 82.03 2gsa_c02 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 2 hits 2gsa_c02 naa= 3 ULMN 3 2isd_c00 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 1 3 # 1 A 311 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 341 GLU A 28 GLU~? 9.11 C3 GOL A 115 A 356 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 121.00 36.37 19.26 121.57 38.37 19.56 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 125.72 32.70 19.75 124.44 34.16 18.84 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 124.34 41.73 25.55 123.79 42.60 23.72 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 2isd_c00 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 2 3 # 2 A 311 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 341 GLU B 28 GLU~? 8.04 O1 BGOL B 114 A 356 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 121.00 36.37 19.26 121.57 38.37 19.56 5.80 25.06 85.89 7.38 24.42 84.67 coo 125.72 32.70 19.75 124.44 34.16 18.84 7.99 29.80 81.55 8.79 31.72 80.96 coo 124.34 41.73 25.55 123.79 42.60 23.72 0.85 27.13 76.55 -1.16 26.55 76.75 2isd_c00 source 2isd PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPASE C, ISO: 2 hits 2isd_c00 naa= 3 ULMN 3 2isd_c01 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 1 3 # 1 B 311 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 341 GLU A 28 GLU~? 9.11 C3 GOL A 115 B 356 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 77.20 37.63 -25.62 77.60 39.62 -25.06 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 79.41 33.66 -21.62 79.55 35.10 -23.14 9.84 -6.23 75.42 9.01 -8.17 75.63 coo 75.11 43.37 -19.22 76.23 44.10 -20.84 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 2isd_c01 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 2 3 # 2 B 311 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 341 GLU B 28 GLU~? 8.04 O1 BGOL B 114 B 356 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 77.20 37.63 -25.62 77.60 39.62 -25.06 5.80 25.06 85.89 7.38 24.42 84.67 coo 79.41 33.66 -21.62 79.55 35.10 -23.14 7.99 29.80 81.55 8.79 31.72 80.96 coo 75.11 43.37 -19.22 76.23 44.10 -20.84 0.85 27.13 76.55 -1.16 26.55 76.75 2isd_c01 source 2isd PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPASE C, ISO: 2 hits 2isd_c01 naa= 3 ULMN 3 2jxr_c04 LIGAND CP-081282 user 1 3 # 1 A 32 ASP A 16 ASP~? 16.03 O2 GOL A 115 A 35 SER A 15 SER~? 16.97 O3 GOL A 115 A 215 ASP A 62 ASP.? 15.17 O2 GOL A 115 coo -14.00 61.45 43.99 -14.19 63.14 42.84 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo -13.21 66.21 45.84 -15.49 65.90 45.84 -5.12 -7.38 63.82 -4.66 -9.00 65.56 coo -10.72 64.19 37.77 -12.20 64.43 39.15 -2.26 2.59 64.84 -3.73 2.30 63.39 ULMN 3 2jxr_c04 LIGAND CP-081282 user 2 3 # 2 A 32 ASP B 16 ASP~? 15.56 O2 BGOL B 114 A 35 SER B 15 SER~? 17.11 O1 AGOL B 114 A 215 ASP B 62 ASP.? 15.08 O2 BGOL B 114 coo -14.00 61.45 43.99 -14.19 63.14 42.84 9.86 30.83 63.58 9.25 29.72 61.91 coo -13.21 66.21 45.84 -15.49 65.90 45.84 6.70 34.48 63.20 7.42 36.00 64.96 coo -10.72 64.19 37.77 -12.20 64.43 39.15 4.69 24.83 64.29 4.38 25.55 62.31 2jxr_c04 source 2jxr LIGAND CP-081282 : 2 hits 2jxr_c04 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 56 PHE.? 19.44 O2 AGOL B 114 A 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 292 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 51.51 50.32 16.39 52.13 49.68 13.75 -3.27 19.66 62.15 -1.03 19.03 60.63 coo 54.43 44.82 23.74 55.21 45.06 21.80 4.69 24.83 64.29 4.38 25.55 62.31 coo 63.95 45.30 16.71 59.11 49.15 16.05 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 177 PHE A 101 PHE^? 15.37 O2 AGOL B 114 A 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 292 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 51.51 50.32 16.39 52.13 49.68 13.75 7.22 14.91 63.43 4.75 15.06 62.17 coo 54.43 44.82 23.74 55.21 45.06 21.80 4.69 24.83 64.29 4.38 25.55 62.31 coo 63.95 45.30 16.71 59.11 49.15 16.05 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 A 177 PHE B 94 PHE~? 11.42 O3 AGOL B 114 A 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 A 292 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 51.51 50.32 16.39 52.13 49.68 13.75 1.02 29.70 71.33 1.10 27.58 73.12 coo 54.43 44.82 23.74 55.21 45.06 21.80 4.69 24.83 64.29 4.38 25.55 62.31 coo 63.95 45.30 16.71 59.11 49.15 16.05 -4.67 17.57 66.69 -7.33 13.35 64.02 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 101 PHE^? 15.37 O2 AGOL B 114 B 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 292 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 49.99 26.05 6.28 51.46 26.87 8.49 7.22 14.91 63.43 4.75 15.06 62.17 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 4.69 24.83 64.29 4.38 25.55 62.31 coo 60.53 31.67 0.97 57.79 27.51 3.63 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 177 PHE B 94 PHE~? 11.42 O3 AGOL B 114 B 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 B 292 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 49.99 26.05 6.28 51.46 26.87 8.49 1.02 29.70 71.33 1.10 27.58 73.12 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 4.69 24.83 64.29 4.38 25.55 62.31 coo 60.53 31.67 0.97 57.79 27.51 3.63 -4.67 17.57 66.69 -7.33 13.35 64.02 2oat_c04 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c04 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 56 PHE.? 19.44 O2 AGOL B 114 C 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 292 LYS B 92 LYS~? 22.65 O3 AGOL B 114 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 -3.27 19.66 62.15 -1.03 19.03 60.63 coo 19.84 12.02 9.33 18.68 11.23 7.75 4.69 24.83 64.29 4.38 25.55 62.31 coo 12.82 3.49 4.98 17.80 5.59 1.90 -5.61 30.35 71.49 -11.81 30.46 73.02 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 177 PHE A 101 PHE^? 15.37 O2 AGOL B 114 C 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 292 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 7.22 14.91 63.43 4.75 15.06 62.17 coo 19.84 12.02 9.33 18.68 11.23 7.75 4.69 24.83 64.29 4.38 25.55 62.31 coo 12.82 3.49 4.98 17.80 5.59 1.90 -4.67 17.57 66.69 -7.33 13.35 64.02 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 C 177 PHE B 94 PHE~? 11.42 O3 AGOL B 114 C 263 ASP B 62 ASP.? 15.08 O2 BGOL B 114 C 292 LYS B 99 LYS^? 20.46 O2 GOL A 115 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 1.02 29.70 71.33 1.10 27.58 73.12 coo 19.84 12.02 9.33 18.68 11.23 7.75 4.69 24.83 64.29 4.38 25.55 62.31 coo 12.82 3.49 4.98 17.80 5.59 1.90 -4.67 17.57 66.69 -7.33 13.35 64.02 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 3 hits 2oat_c05 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 16 ASP~? 16.03 O2 GOL A 115 A 151 LYS A 10 LYS.? 17.78 O2 GOL A 115 A 186 THR A 18 THR~? 16.16 O3 GOL A 115 coo 41.42 17.90 44.98 43.39 18.36 45.61 -6.36 -4.07 67.12 -7.21 -2.58 65.89 coo 45.75 16.58 39.61 47.43 18.26 45.54 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo 45.88 23.02 44.72 46.99 21.16 44.68 -0.94 -8.43 66.77 -0.62 -9.76 65.12 2phk_c02 source 2phk MC-PEPTIDE : 1 hits 2phk_c02 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 57 ASP.? 26.60 O2 GOL A 115 166 GLY B 91 GLY~? 14.09 O3 AGOL B 114 169 GLU B 22 GLU~? 14.39 O1 BGOL B 114 coo 8.28 6.87 1.62 10.08 5.77 1.34 -7.42 17.52 58.35 -7.76 15.77 57.13 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -3.22 28.60 73.91 -3.61 29.33 73.83 coo -16.67 7.89 2.78 -17.65 6.56 1.49 3.40 33.72 72.05 2.78 34.87 73.76 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP A 57 ASP.? 26.60 O2 GOL A 115 166 GLY B 91 GLY~? 14.09 O3 AGOL B 114 169 GLU B 89 GLU~? 21.63 O3 AGOL B 114 coo 8.28 6.87 1.62 10.08 5.77 1.34 -7.42 17.52 58.35 -7.76 15.77 57.13 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -3.22 28.60 73.91 -3.61 29.33 73.83 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -9.38 32.01 77.42 -10.46 31.89 75.58 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 # 3 141 ASP A 71 ASP~? 16.51 CL CL A 114 166 GLY A 108 GLY.? 6.91 O1 AGOL B 114 169 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo 8.28 6.87 1.62 10.08 5.77 1.34 25.70 13.65 72.38 26.87 11.94 72.89 coo -8.58 13.22 3.21 -8.90 13.15 4.05 17.31 29.05 74.33 17.01 28.36 74.18 coo -16.67 7.89 2.78 -17.65 6.56 1.49 11.50 35.87 67.45 13.35 35.01 67.92 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 # 4 141 ASP A 72 ASP~? 17.54 O2 AGOL B 114 166 GLY A 108 GLY.? 6.91 O1 AGOL B 114 169 GLU B 17 GLU~? 13.61 O1 AGOL B 114 coo 8.28 6.87 1.62 10.08 5.77 1.34 26.30 14.43 67.36 25.07 16.12 67.01 coo -8.58 13.22 3.21 -8.90 13.15 4.05 17.31 29.05 74.33 17.01 28.36 74.18 coo -16.67 7.89 2.78 -17.65 6.56 1.49 11.50 35.87 67.45 13.35 35.01 67.92 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 # 5 141 ASP B 16 ASP~? 15.56 O2 BGOL B 114 166 GLY B 91 GLY~? 14.09 O3 AGOL B 114 169 GLU B 89 GLU~? 21.63 O3 AGOL B 114 coo 8.28 6.87 1.62 10.08 5.77 1.34 9.86 30.83 63.58 9.25 29.72 61.91 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -3.22 28.60 73.91 -3.61 29.33 73.83 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -9.38 32.01 77.42 -10.46 31.89 75.58 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 5 hits 2tdt_c00 naa= 3 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 A 169 TYR A 27 TYR~? -3.63 C1 GOL A 115s A 172 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 267 ASP A 32 ASP.? 10.78 CL CL A 114 coo 26.78 20.44 0.03 28.51 18.26 0.09 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 19.63 -5.14 72.66 19.01 -6.45 74.22 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 A 169 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 172 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 267 ASP A 32 ASP.? 10.78 CL CL A 114 coo 26.78 20.44 0.03 28.51 18.26 0.09 11.79 2.97 71.53 9.83 2.65 69.55 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 19.63 -5.14 72.66 19.01 -6.45 74.22 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 3 3 # 3 A 169 TYR B 27 TYR~? -3.70 O3 AGOL B 114s A 172 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 267 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo 26.78 20.44 0.03 28.51 18.26 0.09 7.36 24.77 79.77 8.81 23.32 81.62 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 5.80 25.06 85.89 7.38 24.42 84.67 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 0.49 28.13 88.01 2.42 28.83 88.55 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 4 3 # 4 A 169 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 172 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 267 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo 26.78 20.44 0.03 28.51 18.26 0.09 2.56 21.42 79.08 2.05 22.43 76.53 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 5.80 25.06 85.89 7.38 24.42 84.67 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 0.49 28.13 88.01 2.42 28.83 88.55 2tmd_c00 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 4 hits 2tmd_c00 naa= 3 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 B 169 TYR A 27 TYR~? -3.63 C1 GOL A 115s B 172 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 267 ASP A 32 ASP.? 10.78 CL CL A 114 coo 44.86 1.98 33.27 42.75 1.12 31.67 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 19.63 -5.14 72.66 19.01 -6.45 74.22 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 B 169 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 172 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 267 ASP A 32 ASP.? 10.78 CL CL A 114 coo 44.86 1.98 33.27 42.75 1.12 31.67 11.79 2.97 71.53 9.83 2.65 69.55 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 19.63 -5.14 72.66 19.01 -6.45 74.22 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 3 3 # 3 B 169 TYR B 27 TYR~? -3.70 O3 AGOL B 114s B 172 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 267 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo 44.86 1.98 33.27 42.75 1.12 31.67 7.36 24.77 79.77 8.81 23.32 81.62 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 5.80 25.06 85.89 7.38 24.42 84.67 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 0.49 28.13 88.01 2.42 28.83 88.55 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 4 3 # 4 B 169 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 172 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 267 ASP B 32 ASP.? 14.27 O1 BGOL B 114 coo 44.86 1.98 33.27 42.75 1.12 31.67 2.56 21.42 79.08 2.05 22.43 76.53 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 5.80 25.06 85.89 7.38 24.42 84.67 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 0.49 28.13 88.01 2.42 28.83 88.55 2tmd_c01 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 4 hits 2tmd_c01 naa= 3 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 A 169 TYR A 27 TYR~? -3.63 C1 GOL A 115s A 172 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 174 TYR A 39 TYR^? 6.40 O1 GOL A 115 coo 26.78 20.44 0.03 28.51 18.26 0.09 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 24.73 15.69 1.93 26.72 14.32 3.31 11.79 2.97 71.53 9.83 2.65 69.55 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 A 169 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 172 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 174 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 26.78 20.44 0.03 28.51 18.26 0.09 11.79 2.97 71.53 9.83 2.65 69.55 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 24.73 15.69 1.93 26.72 14.32 3.31 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 3 3 # 3 A 169 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 172 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 174 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 26.78 20.44 0.03 28.51 18.26 0.09 11.79 2.97 71.53 9.83 2.65 69.55 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 24.73 15.69 1.93 26.72 14.32 3.31 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 4 3 # 4 A 169 TYR B 27 TYR~? -3.70 O3 AGOL B 114s A 172 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 174 TYR B 39 TYR^? 6.45 O3 AGOL B 114 coo 26.78 20.44 0.03 28.51 18.26 0.09 7.36 24.77 79.77 8.81 23.32 81.62 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 0.85 27.13 76.55 -1.16 26.55 76.75 coo 24.73 15.69 1.93 26.72 14.32 3.31 2.56 21.42 79.08 2.05 22.43 76.53 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 5 3 # 5 A 169 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 172 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 174 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 26.78 20.44 0.03 28.51 18.26 0.09 2.56 21.42 79.08 2.05 22.43 76.53 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 0.85 27.13 76.55 -1.16 26.55 76.75 coo 24.73 15.69 1.93 26.72 14.32 3.31 7.36 24.77 79.77 8.81 23.32 81.62 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 6 3 # 6 A 169 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 172 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 174 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 26.78 20.44 0.03 28.51 18.26 0.09 2.56 21.42 79.08 2.05 22.43 76.53 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 5.80 25.06 85.89 7.38 24.42 84.67 coo 24.73 15.69 1.93 26.72 14.32 3.31 7.36 24.77 79.77 8.81 23.32 81.62 2tmd_c02 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 6 hits 2tmd_c02 naa= 3 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 B 169 TYR A 27 TYR~? -3.63 C1 GOL A 115s B 172 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 174 TYR A 39 TYR^? 6.40 O1 GOL A 115 coo 44.86 1.98 33.27 42.75 1.12 31.67 9.34 -1.01 75.16 10.26 -0.19 77.66 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 45.95 0.11 28.25 43.87 0.82 26.55 11.79 2.97 71.53 9.83 2.65 69.55 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 B 169 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 172 HIS A 26 HIS~? 10.00 O1 GOL A 115 B 174 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 44.86 1.98 33.27 42.75 1.12 31.67 11.79 2.97 71.53 9.83 2.65 69.55 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 45.95 0.11 28.25 43.87 0.82 26.55 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 3 3 # 3 B 169 TYR A 39 TYR^? 6.40 O1 GOL A 115 B 172 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 174 TYR A 27 TYR~? -3.63 C1 GOL A 115s coo 44.86 1.98 33.27 42.75 1.12 31.67 11.79 2.97 71.53 9.83 2.65 69.55 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 45.95 0.11 28.25 43.87 0.82 26.55 9.34 -1.01 75.16 10.26 -0.19 77.66 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 4 3 # 4 B 169 TYR B 27 TYR~? -3.70 O3 AGOL B 114s B 172 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 174 TYR B 39 TYR^? 6.45 O3 AGOL B 114 coo 44.86 1.98 33.27 42.75 1.12 31.67 7.36 24.77 79.77 8.81 23.32 81.62 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 0.85 27.13 76.55 -1.16 26.55 76.75 coo 45.95 0.11 28.25 43.87 0.82 26.55 2.56 21.42 79.08 2.05 22.43 76.53 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 5 3 # 5 B 169 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 172 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 174 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 44.86 1.98 33.27 42.75 1.12 31.67 2.56 21.42 79.08 2.05 22.43 76.53 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 0.85 27.13 76.55 -1.16 26.55 76.75 coo 45.95 0.11 28.25 43.87 0.82 26.55 7.36 24.77 79.77 8.81 23.32 81.62 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 6 3 # 6 B 169 TYR B 39 TYR^? 6.45 O3 AGOL B 114 B 172 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 174 TYR B 27 TYR~? -3.70 O3 AGOL B 114s coo 44.86 1.98 33.27 42.75 1.12 31.67 2.56 21.42 79.08 2.05 22.43 76.53 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 5.80 25.06 85.89 7.38 24.42 84.67 coo 45.95 0.11 28.25 43.87 0.82 26.55 7.36 24.77 79.77 8.81 23.32 81.62 2tmd_c03 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 6 hits 2tmd_c03 naa= 3 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 B 59 ARG B 84 ARG~? 19.95 O3 AGOL B 114 B 130 SER B 30 SER~? 7.11 O3 AGOL B 114 B 159 LYS B 85 LYS~? 25.09 O3 AGOL B 114 coo 58.72 31.58 20.45 60.80 29.39 20.94 -8.32 22.59 81.65 -10.97 23.53 80.37 coo 61.66 35.17 10.39 61.29 34.14 12.56 1.68 25.09 82.95 3.64 23.84 82.25 coo 65.38 28.77 21.17 63.49 28.03 16.12 -9.57 27.75 81.15 -15.18 26.42 83.82 2tps_c01 source 2tps THIAMIN PHOSPHATE SYNTHASE : 1 hits 2tps_c01 naa= 3 ULMN 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 1 3 # 1 A 202 HIS A 31 HIS~? 8.53 C1 GOL A 115 A 295 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 296 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 65.34 65.04 50.22 63.95 63.70 51.06 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 63.46 53.34 50.98 63.08 55.39 51.17 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 64.71 54.80 47.28 63.92 56.57 48.06 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 2 3 # 2 A 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 A 295 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 296 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 65.34 65.04 50.22 63.95 63.70 51.06 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 63.46 53.34 50.98 63.08 55.39 51.17 0.85 27.13 76.55 -1.16 26.55 76.75 coo 64.71 54.80 47.28 63.92 56.57 48.06 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 3 3 # 3 A 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 A 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 65.34 65.04 50.22 63.95 63.70 51.06 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 63.46 53.34 50.98 63.08 55.39 51.17 -1.03 31.78 76.72 0.89 32.00 75.91 coo 64.71 54.80 47.28 63.92 56.57 48.06 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 4 3 # 4 A 202 HIS B 31 HIS~? 8.39 O3 AGOL B 114 A 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 65.34 65.04 50.22 63.95 63.70 51.06 5.80 25.06 85.89 7.38 24.42 84.67 coo 63.46 53.34 50.98 63.08 55.39 51.17 -1.03 31.78 76.72 0.89 32.00 75.91 coo 64.71 54.80 47.28 63.92 56.57 48.06 0.85 27.13 76.55 -1.16 26.55 76.75 4kbp_c00 source 4kbp PURPLE ACID PHOSPHATASE : 4 hits 4kbp_c00 naa= 3 ULMN 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 1 3 # 1 B 202 HIS A 31 HIS~? 8.53 C1 GOL A 115 B 295 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 296 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 20.09 23.80 58.44 19.07 25.34 59.44 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 19.00 35.58 58.05 18.83 33.61 58.74 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 22.88 34.01 57.66 22.04 32.37 58.63 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 2 3 # 2 B 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 B 295 HIS B 26 HIS~? 10.11 O3 AGOL B 114 B 296 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 20.09 23.80 58.44 19.07 25.34 59.44 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 19.00 35.58 58.05 18.83 33.61 58.74 0.85 27.13 76.55 -1.16 26.55 76.75 coo 22.88 34.01 57.66 22.04 32.37 58.63 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 3 3 # 3 B 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 B 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 20.09 23.80 58.44 19.07 25.34 59.44 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 19.00 35.58 58.05 18.83 33.61 58.74 -1.03 31.78 76.72 0.89 32.00 75.91 coo 22.88 34.01 57.66 22.04 32.37 58.63 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 4 3 # 4 B 202 HIS B 31 HIS~? 8.39 O3 AGOL B 114 B 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 20.09 23.80 58.44 19.07 25.34 59.44 5.80 25.06 85.89 7.38 24.42 84.67 coo 19.00 35.58 58.05 18.83 33.61 58.74 -1.03 31.78 76.72 0.89 32.00 75.91 coo 22.88 34.01 57.66 22.04 32.37 58.63 0.85 27.13 76.55 -1.16 26.55 76.75 4kbp_c01 source 4kbp PURPLE ACID PHOSPHATASE : 4 hits 4kbp_c01 naa= 3 ULMN 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 1 3 # 1 C 202 HIS A 31 HIS~? 8.53 C1 GOL A 115 C 295 HIS A 90 HIS~? 13.16 C1 GOL A 115 C 296 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 56.07 24.38 61.64 57.15 25.46 60.21 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 57.19 35.56 57.82 57.34 33.47 57.88 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 53.24 34.19 58.78 54.08 32.31 58.44 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 2 3 # 2 C 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 C 295 HIS B 26 HIS~? 10.11 O3 AGOL B 114 C 296 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 56.07 24.38 61.64 57.15 25.46 60.21 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 57.19 35.56 57.82 57.34 33.47 57.88 0.85 27.13 76.55 -1.16 26.55 76.75 coo 53.24 34.19 58.78 54.08 32.31 58.44 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 3 3 # 3 C 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 C 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 C 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 56.07 24.38 61.64 57.15 25.46 60.21 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 57.19 35.56 57.82 57.34 33.47 57.88 -1.03 31.78 76.72 0.89 32.00 75.91 coo 53.24 34.19 58.78 54.08 32.31 58.44 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 4 3 # 4 C 202 HIS B 31 HIS~? 8.39 O3 AGOL B 114 C 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 C 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 56.07 24.38 61.64 57.15 25.46 60.21 5.80 25.06 85.89 7.38 24.42 84.67 coo 57.19 35.56 57.82 57.34 33.47 57.88 -1.03 31.78 76.72 0.89 32.00 75.91 coo 53.24 34.19 58.78 54.08 32.31 58.44 0.85 27.13 76.55 -1.16 26.55 76.75 4kbp_c02 source 4kbp PURPLE ACID PHOSPHATASE : 4 hits 4kbp_c02 naa= 3 ULMN 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 1 3 # 1 D 202 HIS A 31 HIS~? 8.53 C1 GOL A 115 D 295 HIS A 90 HIS~? 13.16 C1 GOL A 115 D 296 HIS A 26 HIS~? 10.00 O1 GOL A 115 coo 61.78 113.98 49.61 62.80 115.33 50.85 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 63.27 125.61 50.94 63.59 123.54 51.16 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 63.24 124.12 46.99 63.79 122.40 48.02 9.87 -1.78 67.67 11.19 -0.83 66.35 ULMN 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 2 3 # 2 D 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 D 295 HIS B 26 HIS~? 10.11 O3 AGOL B 114 D 296 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 61.78 113.98 49.61 62.80 115.33 50.85 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 63.27 125.61 50.94 63.59 123.54 51.16 0.85 27.13 76.55 -1.16 26.55 76.75 coo 63.24 124.12 46.99 63.79 122.40 48.02 -1.03 31.78 76.72 0.89 32.00 75.91 ULMN 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 3 3 # 3 D 202 HIS A 52 HIS.? 19.33 O3 AGOL B 114 D 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 D 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 61.78 113.98 49.61 62.80 115.33 50.85 -10.73 25.66 73.06 -8.90 25.80 74.09 coo 63.27 125.61 50.94 63.59 123.54 51.16 -1.03 31.78 76.72 0.89 32.00 75.91 coo 63.24 124.12 46.99 63.79 122.40 48.02 0.85 27.13 76.55 -1.16 26.55 76.75 ULMN 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 4 3 # 4 D 202 HIS B 31 HIS~? 8.39 O3 AGOL B 114 D 295 HIS B 90 HIS~? 13.22 O3 AGOL B 114 D 296 HIS B 26 HIS~? 10.11 O3 AGOL B 114 coo 61.78 113.98 49.61 62.80 115.33 50.85 5.80 25.06 85.89 7.38 24.42 84.67 coo 63.27 125.61 50.94 63.59 123.54 51.16 -1.03 31.78 76.72 0.89 32.00 75.91 coo 63.24 124.12 46.99 63.79 122.40 48.02 0.85 27.13 76.55 -1.16 26.55 76.75 4kbp_c03 source 4kbp PURPLE ACID PHOSPHATASE : 4 hits 4kbp_c03 naa= 3 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 1 3 # 1 71 ARG A 3 ARG^? 7.23 O2 AGOL B 114 127 ARG B 42 ARG^? 8.41 O2 AGOL B 114 270 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo -1.14 25.72 1.64 0.76 28.10 1.50 13.50 14.36 73.75 10.91 14.83 75.22 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 10.15 17.42 72.76 8.76 14.87 71.71 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 7.17 5.83 75.53 6.75 7.34 76.93 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 2 3 # 2 71 ARG A 42 ARG^? 5.53 O2 GOL A 115 127 ARG B 3 ARG^? 7.55 O2 GOL A 115 270 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo -1.14 25.72 1.64 0.76 28.10 1.50 2.91 6.62 75.93 0.97 5.83 78.22 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 2.10 9.57 79.57 4.68 9.08 78.05 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 8.17 18.37 77.00 9.28 16.58 76.89 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 3 3 # 3 71 ARG B 3 ARG^? 7.55 O2 GOL A 115 127 ARG A 42 ARG^? 5.53 O2 GOL A 115 270 GLU B 40 GLU^? -5.07 O3 BGOL B 114s coo -1.14 25.72 1.64 0.76 28.10 1.50 2.10 9.57 79.57 4.68 9.08 78.05 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 2.91 6.62 75.93 0.97 5.83 78.22 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 8.17 18.37 77.00 9.28 16.58 76.89 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 4 3 # 4 71 ARG B 42 ARG^? 8.41 O2 AGOL B 114 127 ARG A 3 ARG^? 7.23 O2 AGOL B 114 270 GLU A 40 GLU^? -5.26 O1 GOL A 115s coo -1.14 25.72 1.64 0.76 28.10 1.50 10.15 17.42 72.76 8.76 14.87 71.71 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 13.50 14.36 73.75 10.91 14.83 75.22 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 7.17 5.83 75.53 6.75 7.34 76.93 5cpa_c01 source 5cpa CARBOXYPEPTIDASE A=ALPHA= (COX) (E.C.3.4.17.1): 4 hits 5cpa_c01 naa= 3 ULMN 4 2j60_p00 FICOLIN-3 user 1 4 # 1 A 235 CYH A 67 CYH^? 10.62 O1 GOL A 115 A 236 TYR A 39 TYR^? 6.40 O1 GOL A 115 A 254 TYR A 6 TYR^? 13.03 O1 GOL A 115 A 264 VAL A 41 VAL^? -4.33 O1 GOL A 115s coo -18.75 -43.51 -53.56 -16.40 -44.98 -53.32 13.60 7.87 70.43 13.69 6.07 68.33 coo -18.22 -38.86 -51.52 -15.95 -37.29 -51.90 11.79 2.97 71.53 9.83 2.65 69.55 coo -11.61 -39.12 -53.15 -11.40 -40.56 -55.54 9.35 7.19 64.40 12.10 6.95 63.91 coo -15.41 -33.14 -55.14 -15.76 -35.26 -55.51 5.93 3.41 72.11 5.68 1.56 70.98 ULMN 4 2j60_p00 FICOLIN-3 user 2 4 # 2 A 235 CYH B 67 CYH^? 10.77 O3 AGOL B 114 A 236 TYR B 39 TYR^? 6.45 O3 AGOL B 114 A 254 TYR B 6 TYR^? 13.17 O3 AGOL B 114 A 264 VAL B 41 VAL^? -4.32 O3 AGOL B 114s coo -18.75 -43.51 -53.56 -16.40 -44.98 -53.32 0.03 16.72 79.11 -1.50 18.92 78.46 coo -18.22 -38.86 -51.52 -15.95 -37.29 -51.90 2.56 21.42 79.08 2.05 22.43 76.53 coo -11.61 -39.12 -53.15 -11.40 -40.56 -55.54 -2.31 18.55 72.58 -4.15 18.18 74.66 coo -15.41 -33.14 -55.14 -15.76 -35.26 -55.51 6.22 21.41 74.51 5.68 23.46 74.15 2j60_p00 source 2j60 FICOLIN-3 : 2 hits 2j60_p00 naa= 4 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 39 TYR^? 6.40 O1 GOL A 115 I 306 VAL A 41 VAL^? -4.33 O1 GOL A 115s I 308 VAL B 106 VAL.? -3.83 O3 GOL A 115s coo 26.18 35.24 6.87 24.33 35.18 8.97 11.79 2.97 71.53 9.83 2.65 69.55 coo 23.55 29.53 9.81 23.15 27.39 10.24 5.93 3.41 72.11 5.68 1.56 70.98 coo 16.43 30.18 9.35 15.05 30.67 11.01 1.31 -1.09 74.75 3.06 -0.73 73.51 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR B 39 TYR^? 6.45 O3 AGOL B 114 I 306 VAL B 41 VAL^? -4.32 O3 AGOL B 114s I 308 VAL A 106 VAL.? -3.69 O2 BGOL B 114s coo 26.18 35.24 6.87 24.33 35.18 8.97 2.56 21.42 79.08 2.05 22.43 76.53 coo 23.55 29.53 9.81 23.15 27.39 10.24 6.22 21.41 74.51 5.68 23.46 74.15 coo 16.43 30.18 9.35 15.05 30.67 11.01 11.60 25.74 73.20 9.53 25.42 73.82 1cqt_d00 source 1cqt GENE REGULATION/DNA : 2 hits 1cqt_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 100 PRO.? 16.56 O1 GOL A 115 A 272 LEU A 4 LEU^? 15.07 O2 AGOL B 114 A 276 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 12.66 10.27 62.31 10.54 10.39 61.62 coo 10.97 0.43 16.73 11.31 2.11 18.06 13.63 10.81 66.40 15.28 11.44 65.10 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO A 100 PRO.? 16.56 O1 GOL A 115 A 272 LEU A 4 LEU^? 15.07 O2 AGOL B 114 A 276 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 12.66 10.27 62.31 10.54 10.39 61.62 coo 10.97 0.43 16.73 11.31 2.11 18.06 13.63 10.81 66.40 15.28 11.44 65.10 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 10.15 17.42 72.76 8.76 14.87 71.71 ULMN 3 1emh_d00 HYDROLASE/DNA user 3 3 # 3 A 271 PRO A 100 PRO.? 16.56 O1 GOL A 115 A 272 LEU A 5 LEU^? 12.71 O1 GOL A 115 A 276 ARG A 3 ARG^? 7.23 O2 AGOL B 114 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 12.66 10.27 62.31 10.54 10.39 61.62 coo 10.97 0.43 16.73 11.31 2.11 18.06 8.14 12.29 67.68 5.99 12.37 68.23 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 13.50 14.36 73.75 10.91 14.83 75.22 ULMN 3 1emh_d00 HYDROLASE/DNA user 4 3 # 4 A 271 PRO A 100 PRO.? 16.56 O1 GOL A 115 A 272 LEU A 5 LEU^? 12.71 O1 GOL A 115 A 276 ARG B 42 ARG^? 8.41 O2 AGOL B 114 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 12.66 10.27 62.31 10.54 10.39 61.62 coo 10.97 0.43 16.73 11.31 2.11 18.06 8.14 12.29 67.68 5.99 12.37 68.23 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 10.15 17.42 72.76 8.76 14.87 71.71 1emh_d00 source 1emh HYDROLASE/DNA : 4 hits 1emh_d00 naa= 3 ULMN 4 2q2t_d00 LIGASE/DNA user 1 4 # 1 A 48 ARG A 42 ARG^? 5.53 O2 GOL A 115 A 249 THR B 93 THR~? 17.37 O3 AGOL B 114 A 285 ARG B 84 ARG~? 19.95 O3 AGOL B 114 A 286 PHE B 88 PHE~? 16.23 O3 AGOL B 114 coo -81.95 4.55 64.73 -81.11 4.84 61.78 2.91 6.62 75.93 0.97 5.83 78.22 coo -64.79 -0.51 43.10 -64.46 -1.42 45.04 -2.97 33.11 71.20 -2.14 34.67 72.49 coo -72.24 -8.41 51.99 -72.03 -9.47 54.89 -8.32 22.59 81.65 -10.97 23.53 80.37 coo -68.50 -7.10 50.68 -69.42 -6.74 53.31 -7.55 25.15 77.46 -7.26 22.37 77.78 2q2t_d00 source 2q2t LIGASE/DNA : 1 hits 2q2t_d00 naa= 4 ULMN 4 2wwy_d00 HYDROLASE/DNA user 1 4 # 1 B 562 THR A 77 THR~? 7.97 CL CL A 114 B 563 ALA A 74 ALA~? 12.87 CL CL A 114 B 564 TYR A 75 TYR~? 14.24 CL CL A 114 B 565 ALA A 76 ALA~? 12.30 CL CL A 114 coo -5.20 24.72 16.34 -4.97 25.16 14.25 26.87 4.77 66.75 27.82 4.19 68.58 coo -7.97 22.24 17.04 -9.46 22.49 16.89 25.49 8.30 70.20 24.56 8.58 71.38 coo -9.19 19.01 13.84 -11.68 18.26 14.90 21.81 10.09 65.59 20.00 9.75 63.52 coo -3.33 20.88 13.35 -3.51 21.15 11.86 26.32 8.07 64.90 27.66 8.78 64.86 ULMN 4 2wwy_d00 HYDROLASE/DNA user 2 4 # 2 B 562 THR A 77 THR~? 7.97 CL CL A 114 B 563 ALA A 76 ALA~? 12.30 CL CL A 114 B 564 TYR A 75 TYR~? 14.24 CL CL A 114 B 565 ALA A 73 ALA~? 14.84 CL CL A 114 coo -5.20 24.72 16.34 -4.97 25.16 14.25 26.87 4.77 66.75 27.82 4.19 68.58 coo -7.97 22.24 17.04 -9.46 22.49 16.89 26.32 8.07 64.90 27.66 8.78 64.86 coo -9.19 19.01 13.84 -11.68 18.26 14.90 21.81 10.09 65.59 20.00 9.75 63.52 coo -3.33 20.88 13.35 -3.51 21.15 11.86 28.18 10.66 68.87 29.20 10.77 70.00 ULMN 4 2wwy_d00 HYDROLASE/DNA user 3 4 # 3 B 562 THR A 77 THR~? 7.97 CL CL A 114 B 563 ALA A 76 ALA~? 12.30 CL CL A 114 B 564 TYR A 75 TYR~? 14.24 CL CL A 114 B 565 ALA A 74 ALA~? 12.87 CL CL A 114 coo -5.20 24.72 16.34 -4.97 25.16 14.25 26.87 4.77 66.75 27.82 4.19 68.58 coo -7.97 22.24 17.04 -9.46 22.49 16.89 26.32 8.07 64.90 27.66 8.78 64.86 coo -9.19 19.01 13.84 -11.68 18.26 14.90 21.81 10.09 65.59 20.00 9.75 63.52 coo -3.33 20.88 13.35 -3.51 21.15 11.86 25.49 8.30 70.20 24.56 8.58 71.38 ULMN 4 2wwy_d00 HYDROLASE/DNA user 4 4 # 4 B 562 THR B 77 THR~? 22.17 O3 AGOL B 114 B 563 ALA B 74 ALA~? 19.17 O3 BGOL B 114 B 564 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 565 ALA B 76 ALA~? 24.08 O2 GOL A 115 coo -5.20 24.72 16.34 -4.97 25.16 14.25 -10.01 18.85 88.65 -8.96 18.82 90.53 coo -7.97 22.24 17.04 -9.46 22.49 16.89 -6.80 15.03 88.56 -5.34 14.59 88.44 coo -9.19 19.01 13.84 -11.68 18.26 14.90 -8.67 14.69 82.60 -9.45 15.65 80.11 coo -3.33 20.88 13.35 -3.51 21.15 11.86 -11.59 16.12 86.49 -12.40 15.23 87.44 ULMN 4 2wwy_d00 HYDROLASE/DNA user 5 4 # 5 B 562 THR B 77 THR~? 22.17 O3 AGOL B 114 B 563 ALA B 76 ALA~? 24.08 O2 GOL A 115 B 564 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 565 ALA B 73 ALA~? 22.70 O2 GOL A 115 coo -5.20 24.72 16.34 -4.97 25.16 14.25 -10.01 18.85 88.65 -8.96 18.82 90.53 coo -7.97 22.24 17.04 -9.46 22.49 16.89 -11.59 16.12 86.49 -12.40 15.23 87.44 coo -9.19 19.01 13.84 -11.68 18.26 14.90 -8.67 14.69 82.60 -9.45 15.65 80.11 coo -3.33 20.88 13.35 -3.51 21.15 11.86 -9.75 12.81 89.45 -9.58 12.39 90.91 ULMN 4 2wwy_d00 HYDROLASE/DNA user 6 4 # 6 B 562 THR B 77 THR~? 22.17 O3 AGOL B 114 B 563 ALA B 76 ALA~? 24.08 O2 GOL A 115 B 564 TYR B 75 TYR~? 19.43 O3 BGOL B 114 B 565 ALA B 74 ALA~? 19.17 O3 BGOL B 114 coo -5.20 24.72 16.34 -4.97 25.16 14.25 -10.01 18.85 88.65 -8.96 18.82 90.53 coo -7.97 22.24 17.04 -9.46 22.49 16.89 -11.59 16.12 86.49 -12.40 15.23 87.44 coo -9.19 19.01 13.84 -11.68 18.26 14.90 -8.67 14.69 82.60 -9.45 15.65 80.11 coo -3.33 20.88 13.35 -3.51 21.15 11.86 -6.80 15.03 88.56 -5.34 14.59 88.44 2wwy_d00 source 2wwy HYDROLASE/DNA : 6 hits 2wwy_d00 naa= 4 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 18 SER A 30 SER~? 7.32 O1 GOL A 115 A 20 HIS A 26 HIS~? 10.00 O1 GOL A 115 A 22 LEU A 8 LEU^? 11.35 O1 GOL A 115 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 15.10 -1.32 71.94 13.61 -0.13 73.45 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 9.87 -1.78 67.67 11.19 -0.83 66.35 coo -14.55 2.62 13.63 -14.94 2.66 11.50 3.33 3.85 64.40 5.37 3.55 65.11 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 18 SER B 30 SER~? 7.11 O3 AGOL B 114 A 20 HIS B 26 HIS~? 10.11 O3 AGOL B 114 A 22 LEU B 8 LEU^? 11.52 O3 AGOL B 114 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 1.68 25.09 82.95 3.64 23.84 82.25 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 0.85 27.13 76.55 -1.16 26.55 76.75 coo -14.55 2.62 13.63 -14.94 2.66 11.50 1.01 22.88 68.29 0.47 22.63 70.39 3gxq_d00 source 3gxq DNA BINDING PROTEIN/DNA : 2 hits 3gxq_d00 naa= 3 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 1 4 # 1 B 122 ARG A 84 ARG~? 10.06 CL CL A 114 B 148 LYS A 10 LYS.? 17.78 O2 GOL A 115 B 151 LEU A 8 LEU^? 11.35 O1 GOL A 115 B 154 ILE A 95 ILE~? 11.08 O1 GOL A 115 coo 13.00 32.05 60.31 16.02 31.73 59.80 19.14 1.97 63.54 20.03 2.37 60.64 coo 11.05 44.13 44.68 12.77 44.45 49.56 -0.73 -0.44 61.58 -5.71 -3.55 62.52 coo 11.72 38.91 44.77 13.11 39.67 46.23 3.33 3.85 64.40 5.37 3.55 65.11 coo 7.03 36.97 46.99 7.83 37.90 47.52 5.31 -1.20 64.70 6.33 -1.25 65.76 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 2 4 # 2 B 122 ARG B 20 ARG~? 7.55 O1 AGOL B 114 B 148 LYS B 99 LYS^? 20.46 O2 GOL A 115 B 151 LEU B 7 LEU^? 15.26 O2 AGOL B 114 B 154 ILE B 64 ILE^? 9.82 O2 AGOL B 114 coo 13.00 32.05 60.31 16.02 31.73 59.80 12.50 29.25 70.09 15.28 27.90 70.29 coo 11.05 44.13 44.68 12.77 44.45 49.56 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 11.72 38.91 44.77 13.11 39.67 46.23 0.09 17.58 65.96 0.89 15.60 65.66 coo 7.03 36.97 46.99 7.83 37.90 47.52 5.14 17.62 69.62 5.30 16.38 69.04 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 3 4 # 3 B 122 ARG B 20 ARG~? 7.55 O1 AGOL B 114 B 148 LYS B 99 LYS^? 20.46 O2 GOL A 115 B 151 LEU B 98 LEU^? 15.73 O3 AGOL B 114 B 154 ILE B 95 ILE~? 14.21 O3 AGOL B 114 coo 13.00 32.05 60.31 16.02 31.73 59.80 12.50 29.25 70.09 15.28 27.90 70.29 coo 11.05 44.13 44.68 12.77 44.45 49.56 -4.67 17.57 66.69 -7.33 13.35 64.02 coo 11.72 38.91 44.77 13.11 39.67 46.23 -4.85 21.95 68.20 -4.21 21.57 70.16 coo 7.03 36.97 46.99 7.83 37.90 47.52 -2.52 26.61 69.33 -2.35 25.36 70.10 3odc_d00 source 3odc DNA BINDING PROTEIN/DNA : 3 hits 3odc_d00 naa= 4 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 G 386 ARG A 25 ARG~? 12.92 C1 GOL A 115 G 387 HIS A 26 HIS~? 10.00 O1 GOL A 115 G 390 SER A 30 SER~? 7.32 O1 GOL A 115 coo 93.17 52.97 31.81 95.66 54.71 32.14 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 95.60 53.07 40.31 97.10 52.52 41.67 9.87 -1.78 67.67 11.19 -0.83 66.35 coo 93.25 46.91 38.79 94.12 47.43 36.62 15.10 -1.32 71.94 13.61 -0.13 73.45 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 G 386 ARG A 25 ARG~? 12.92 C1 GOL A 115 G 387 HIS A 31 HIS~? 8.53 C1 GOL A 115 G 390 SER A 30 SER~? 7.32 O1 GOL A 115 coo 93.17 52.97 31.81 95.66 54.71 32.14 9.84 -9.08 71.15 12.58 -9.77 72.33 coo 95.60 53.07 40.31 97.10 52.52 41.67 15.30 -2.41 76.92 13.57 -1.61 77.79 coo 93.25 46.91 38.79 94.12 47.43 36.62 15.10 -1.32 71.94 13.61 -0.13 73.45 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 G 386 ARG B 25 ARG~? 13.22 O1 BGOL B 114 G 387 HIS B 26 HIS~? 10.11 O3 AGOL B 114 G 390 SER B 30 SER~? 7.11 O3 AGOL B 114 coo 93.17 52.97 31.81 95.66 54.71 32.14 3.18 34.46 77.89 5.47 36.12 76.56 coo 95.60 53.07 40.31 97.10 52.52 41.67 0.85 27.13 76.55 -1.16 26.55 76.75 coo 93.25 46.91 38.79 94.12 47.43 36.62 1.68 25.09 82.95 3.64 23.84 82.25 3qrf_d00 source 3qrf DNA BINDING PROTEIN/DNA : 3 hits 3qrf_d00 naa= 3 ULMN 3 3uby_d00 HYDROLASE/DNA user 1 3 # 1 A 162 TYR A 75 TYR~? 14.24 CL CL A 114 A 164 MET A 79 MET?? 11.91 CL CL A 114 A 165 TYR A 78 TYR~? 10.44 CL CL A 114 coo 9.07 -0.64 37.53 6.51 -1.49 38.21 21.81 10.09 65.59 20.00 9.75 63.52 coo 15.31 0.97 33.48 17.04 -1.81 36.11 23.19 4.71 62.69 20.45 6.20 61.78 coo 12.73 -3.12 32.95 14.22 -4.94 34.46 20.68 4.89 66.65 17.95 4.78 66.23 ULMN 3 3uby_d00 HYDROLASE/DNA user 2 3 # 2 A 162 TYR B 75 TYR~? 19.43 O3 BGOL B 114 A 164 MET B 79 MET?? 19.85 O3 AGOL B 114 A 165 TYR B 78 TYR~? 15.72 O3 AGOL B 114 coo 9.07 -0.64 37.53 6.51 -1.49 38.21 -8.67 14.69 82.60 -9.45 15.65 80.11 coo 15.31 0.97 33.48 17.04 -1.81 36.11 -11.31 20.27 83.46 -10.69 19.23 80.40 coo 12.73 -3.12 32.95 14.22 -4.94 34.46 -6.72 19.79 83.49 -5.56 20.39 81.01 3uby_d00 source 3uby HYDROLASE/DNA : 2 hits 3uby_d00 naa= 3 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 C 61 LYS B 99 LYS^? 20.46 O2 GOL A 115 C 90 HIS B 60 HIS.? 17.24 O2 AGOL B 114 C 91 GLN B 47 GLN.? 17.09 O2 AGOL B 114 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 -4.67 17.57 66.69 -7.33 13.35 64.02 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 4.96 22.92 58.66 6.72 23.67 59.53 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 7.79 18.62 60.03 5.90 19.35 59.41 4hp3_d00 source 4hp3 DNA BINDING PROTEIN/DNA : 1 hits 4hp3_d00 naa= 3 ULMN 3 2io8_o00 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE user 1 3 # 1 A 59 CYH A 23 CYH~? 8.53 O2 GOL A 115 A 131 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 147 GLU A 22 GLU~? 14.62 C1 GOL A 115 coo 4.62 -21.76 1.74 6.07 -20.80 -0.50 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 9.76 -23.46 -1.15 9.10 -24.76 0.37 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 8.38 -27.41 3.38 10.22 -28.03 2.51 3.69 -7.10 65.54 5.12 -8.60 65.19 ULMN 3 2io8_o00 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE user 2 3 # 2 A 59 CYH B 23 CYH~? 8.19 O2 BGOL B 114 A 131 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 147 GLU B 22 GLU~? 14.39 O1 BGOL B 114 coo 4.62 -21.76 1.74 6.07 -20.80 -0.50 5.26 28.04 73.57 5.28 26.63 71.09 coo 9.76 -23.46 -1.15 9.10 -24.76 0.37 -1.03 31.78 76.72 0.89 32.00 75.91 coo 8.38 -27.41 3.38 10.22 -28.03 2.51 3.40 33.72 72.05 2.78 34.87 73.76 2io8_o00 source 2IO8 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE : 2 hits 2io8_o00 naa= 3 ULMN 3 2io8_o01 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE user 1 3 # 1 B 59 CYH A 23 CYH~? 8.53 O2 GOL A 115 B 131 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 147 GLU A 22 GLU~? 14.62 C1 GOL A 115 coo -23.62 8.42 38.13 -23.12 8.59 40.92 4.86 -2.67 69.49 3.11 -0.86 68.28 coo -24.26 12.74 42.29 -24.88 13.35 40.38 10.26 -5.82 64.75 8.54 -6.13 65.90 coo -26.18 14.57 36.88 -26.42 16.30 38.13 3.69 -7.10 65.54 5.12 -8.60 65.19 ULMN 3 2io8_o01 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE user 2 3 # 2 B 59 CYH B 23 CYH~? 8.19 O2 BGOL B 114 B 131 HIS B 90 HIS~? 13.22 O3 AGOL B 114 B 147 GLU B 22 GLU~? 14.39 O1 BGOL B 114 coo -23.62 8.42 38.13 -23.12 8.59 40.92 5.26 28.04 73.57 5.28 26.63 71.09 coo -24.26 12.74 42.29 -24.88 13.35 40.38 -1.03 31.78 76.72 0.89 32.00 75.91 coo -26.18 14.57 36.88 -26.42 16.30 38.13 3.40 33.72 72.05 2.78 34.87 73.76 2io8_o01 source 2IO8 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE : 2 hits 2io8_o01 naa= 3 ULMN 3 2io9_o01 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE user 1 3 # 1 B 59 CYH A 23 CYH~? 8.53 O2 GOL A 115 B 131 HIS A 90 HIS~? 13.16 C1 GOL A 115 B 147 GLU A 22 GLU~? 14.62 C1 GOL A 115 coo -23.64 8.52 37.93 -23.29 8.46 40.73 4.86 -2.67 69.49 3.11 -0.86 68.28 coo -24.27 12.78 41.98 -24.92 13.24 40.03 10.26 -5.82 64.75 8.54 -6.13 65.90 coo -26.15 14.67 36.54 -26.29 16.45 37.81 3.69 -7.10 65.54 5.12 -8.60 65.19 2io9_o01 source 2IO9 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE : 1 hits 2io9_o01 naa= 3 ULMN 3 2iob_o00 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE user 1 3 # 1 A 59 CYH A 23 CYH~? 8.53 O2 GOL A 115 A 131 HIS A 90 HIS~? 13.16 C1 GOL A 115 A 147 GLU A 22 GLU~? 14.62 C1 GOL A 115 coo 46.25 -21.66 30.20 48.53 -20.98 31.92 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 48.70 -24.47 35.03 47.31 -25.39 33.75 10.26 -5.82 64.75 8.54 -6.13 65.90 coo 44.38 -27.64 32.53 44.94 -28.52 34.37 3.69 -7.10 65.54 5.12 -8.60 65.19 ULMN 3 2iob_o00 BIFUNCTIONAL GLUTATHIONYLSPERMIDINE user 2 3 # 2 A 59 CYH B 23 CYH~? 8.19 O2 BGOL B 114 A 131 HIS B 90 HIS~? 13.22 O3 AGOL B 114 A 147 GLU B 22 GLU~? 14.39 O1 BGOL B 114 coo 46.25 -21.66 30.20 48.53 -20.98 31.92 5.26 28.04 73.57 5.28 26.63 71.09 coo 48.70 -24.47 35.03 47.31 -25.39 33.75 -1.03 31.78 76.72 0.89 32.00 75.91 coo 44.38 -27.64 32.53 44.94 -28.52 34.37 3.40 33.72 72.05 2.78 34.87 73.76 2iob_o00 source 2IOB BIFUNCTIONAL GLUTATHIONYLSPERMIDINE : 2 hits 2iob_o00 naa= 3 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 E 49 ASP B 62 ASP.? 15.08 O2 BGOL B 114 E 86 HIS B 60 HIS.? 17.24 O2 AGOL B 114 E 250 ALA B 45 ALA^? 11.50 O2 AGOL B 114 coo -36.18 24.97 18.78 -36.93 26.11 17.11 4.69 24.83 64.29 4.38 25.55 62.31 coo -36.85 29.32 15.06 -38.90 29.14 15.48 4.96 22.92 58.66 6.72 23.67 59.53 coo -44.49 29.68 13.98 -43.47 28.67 13.52 12.95 21.14 63.86 14.23 20.76 64.58 2wwt_o04 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 1 hits 2wwt_o04 naa= 3 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 F 49 ASP B 62 ASP.? 15.08 O2 BGOL B 114 F 86 HIS B 60 HIS.? 17.24 O2 AGOL B 114 F 250 ALA B 45 ALA^? 11.50 O2 AGOL B 114 coo -82.12 8.55 35.60 -81.93 9.84 37.19 4.69 24.83 64.29 4.38 25.55 62.31 coo -84.21 11.81 39.90 -82.43 12.70 39.26 4.96 22.92 58.66 6.72 23.67 59.53 coo -78.49 17.13 41.31 -79.25 15.85 41.61 12.95 21.14 63.86 14.23 20.76 64.58 2wwt_o05 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 1 hits 2wwt_o05 naa= 3 ULMN 3 3tu8_o00 BURKHOLDERIA LETHAL FACTOR 1 (BLF1) user 1 3 # 1 A 88 THR A 93 THR~? 19.76 CL CL A 114 A 94 CYH A 23 CYH~? 8.53 O2 GOL A 115 A 106 HIS A 90 HIS~? 13.16 C1 GOL A 115 coo 29.73 -7.52 13.32 29.45 -5.70 12.17 7.62 -4.06 58.49 8.48 -5.78 57.55 coo 31.46 -1.21 4.47 31.00 -3.95 4.28 4.86 -2.67 69.49 3.11 -0.86 68.28 coo 27.96 -4.35 8.55 29.78 -5.07 7.70 10.26 -5.82 64.75 8.54 -6.13 65.90 ULMN 3 3tu8_o00 BURKHOLDERIA LETHAL FACTOR 1 (BLF1) user 2 3 # 2 A 88 THR B 93 THR~? 17.37 O3 AGOL B 114 A 94 CYH B 23 CYH~? 8.19 O2 BGOL B 114 A 106 HIS B 90 HIS~? 13.22 O3 AGOL B 114 coo 29.73 -7.52 13.32 29.45 -5.70 12.17 -2.97 33.11 71.20 -2.14 34.67 72.49 coo 31.46 -1.21 4.47 31.00 -3.95 4.28 5.26 28.04 73.57 5.28 26.63 71.09 coo 27.96 -4.35 8.55 29.78 -5.07 7.70 -1.03 31.78 76.72 0.89 32.00 75.91 3tu8_o00 source 3TU8 BURKHOLDERIA LETHAL FACTOR 1 (BLF1) : 2 hits 3tu8_o00 naa= 3