*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 86 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 250 ALA A 67 ALA~? 21.79 O2 GOL A1148 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 13.54 20.21 31.37 12.47 20.57 29.56 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 15.28 17.18 36.03 17.14 16.78 35.14 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 11.54 19.14 41.93 12.74 19.20 42.85 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 86 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 250 ALA A 118 ALA.? 18.69 O3 SO4 A1146 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 -0.83 10.88 33.15 0.71 12.12 33.87 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 4.14 13.68 32.87 3.48 14.92 34.43 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 -1.61 18.57 37.21 -0.61 19.44 36.46 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 4 1cd5_c00 GLUCOSAMINE 6-PHOSPHATE DEAMINASE user 1 4 # 1 A 72 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 141 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 143 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 148 GLU A 80 GLU~? 13.34 C1 GOL A1147 coo 86.21 51.78 11.27 86.87 50.27 12.61 13.54 20.21 31.37 12.47 20.57 29.56 coo 77.92 48.13 25.32 78.70 49.17 23.61 -0.83 10.88 33.15 0.71 12.12 33.87 coo 79.83 48.98 19.95 81.76 49.72 20.33 4.14 13.68 32.87 3.48 14.92 34.43 coo 76.11 54.71 19.44 77.75 55.81 18.59 7.67 8.26 27.56 9.41 8.53 26.40 1cd5_c00 source 1cd5 GLUCOSAMINE 6-PHOSPHATE DEAMINASE : 1 hits 1cd5_c00 naa= 4 ULMN 4 1f75_c01 UNDECAPRENYL PYROPHOSPHATE SYNTHETASuser 1 4 # 1 B 33 ARG A 29 ARG~? 10.10 O3 BGOL A1147 B 42 ARG A 77 ARG~? 14.83 O1 GOL A1147 B 197 ARG A 34 ARG.? 5.20 O3 AGOL A1147 B 203 ARG A 32 ARG.? 8.17 O3 AGOL A1147 coo 42.69 1.07 -0.40 42.64 1.65 2.61 7.64 2.56 22.30 9.21 4.89 21.02 coo 53.37 -3.67 -3.96 53.38 -5.27 -1.33 13.84 10.22 30.84 16.69 9.80 29.81 coo 40.75 3.79 10.50 41.03 0.76 9.97 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 36.15 -1.87 10.26 38.18 -1.23 8.01 5.64 -9.61 30.19 6.78 -11.86 28.47 1f75_c01 source 1f75 UNDECAPRENYL PYROPHOSPHATE SYNTHETASE : 1 hits 1f75_c01 naa= 4 ULMN 4 1odt_c00 CEPHALOSPORIN C DEACETYLASE user 1 4 # 1 C 181 ALA A 67 ALA~? 21.79 O2 GOL A1148 C 182 GLN A 66 GLN~? 24.06 O2 GOL A1148 C 269 ASP A 72 ASP.? 25.04 C1 GOL A1147 C 298 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 19.41 78.76 44.53 18.61 79.22 45.75 11.54 19.14 41.93 12.74 19.20 42.85 coo 24.64 81.35 46.97 24.99 82.28 48.83 6.14 19.17 44.53 5.32 20.59 45.87 coo 10.40 79.73 42.00 12.16 80.19 43.16 13.54 20.21 31.37 12.47 20.57 29.56 coo 13.42 79.87 46.31 15.44 80.29 45.93 15.28 17.18 36.03 17.14 16.78 35.14 1odt_c00 source 1odt CEPHALOSPORIN C DEACETYLASE : 1 hits 1odt_c00 naa= 4 ULMN 4 1odt_c01 CEPHALOSPORIN C DEACETYLASE user 1 4 # 1 H 181 ALA A 67 ALA~? 21.79 O2 GOL A1148 H 182 GLN A 66 GLN~? 24.06 O2 GOL A1148 H 269 ASP A 72 ASP.? 25.04 C1 GOL A1147 H 298 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 17.71 105.28 65.69 16.95 104.75 64.54 11.54 19.14 41.93 12.74 19.20 42.85 coo 23.16 103.35 63.17 23.71 102.54 61.29 6.14 19.17 44.53 5.32 20.59 45.87 coo 8.91 102.95 68.35 10.66 102.77 67.10 13.54 20.21 31.37 12.47 20.57 29.56 coo 11.89 103.25 63.94 13.96 103.24 64.24 15.28 17.18 36.03 17.14 16.78 35.14 1odt_c01 source 1odt CEPHALOSPORIN C DEACETYLASE : 1 hits 1odt_c01 naa= 4 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 1 3 # 1 A 46 ASP A 135 ASP~? 12.04 O1 GOL A1148 A 100 ARG A 137 ARG~? 7.86 O1 GOL A1148 A 116 GLN A 44 GLN.? 5.86 O2 GOL A1148 coo 32.24 20.09 5.34 30.38 19.04 5.27 0.67 3.61 47.99 2.00 2.44 49.10 coo 26.40 25.34 6.28 26.15 22.33 7.25 3.45 0.43 53.78 6.50 0.05 53.66 coo 26.74 21.94 13.78 27.57 20.97 12.08 9.32 3.81 46.33 8.65 1.84 46.71 12as_c00 source 12as ASPARAGINE SYNTHETASE : 1 hits 12as_c00 naa= 3 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 1 3 # 1 B 46 ASP A 135 ASP~? 12.04 O1 GOL A1148 B 100 ARG A 137 ARG~? 7.86 O1 GOL A1148 B 116 GLN A 44 GLN.? 5.86 O2 GOL A1148 coo 32.18 48.37 12.48 33.96 49.46 12.97 0.67 3.61 47.99 2.00 2.44 49.10 coo 39.04 43.25 11.37 38.30 45.35 13.56 3.45 0.43 53.78 6.50 0.05 53.66 coo 37.43 42.63 19.41 36.76 44.08 17.97 9.32 3.81 46.33 8.65 1.84 46.71 12as_c01 source 12as ASPARAGINE SYNTHETASE : 1 hits 12as_c01 naa= 3 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 190 LYS A 11 LYS~? 21.22 O2 GOL A1148 A 222 ASP A 6 ASP.? 21.81 O2 GOL A1148 B 140 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo -4.61 20.12 30.34 -2.74 22.65 25.95 21.22 13.78 38.77 26.11 13.41 41.35 coo -1.04 26.60 27.37 -2.94 25.93 26.69 21.58 19.24 41.26 20.54 17.38 41.15 coo 1.51 16.60 24.17 0.82 19.23 24.79 11.51 13.23 39.94 12.02 10.95 38.44 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 190 LYS A 11 LYS~? 21.22 O2 GOL A1148 A 222 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 140 TYR A 57 TYR~? 10.51 O2 GOL A1148 coo -4.61 20.12 30.34 -2.74 22.65 25.95 21.22 13.78 38.77 26.11 13.41 41.35 coo -1.04 26.60 27.37 -2.94 25.93 26.69 21.37 14.29 44.78 22.74 12.93 43.92 coo 1.51 16.60 24.17 0.82 19.23 24.79 17.76 5.01 42.82 20.23 4.84 41.52 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 3 3 # 3 A 190 LYS A 11 LYS~? 21.22 O2 GOL A1148 A 222 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 140 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo -4.61 20.12 30.34 -2.74 22.65 25.95 21.22 13.78 38.77 26.11 13.41 41.35 coo -1.04 26.60 27.37 -2.94 25.93 26.69 21.37 14.29 44.78 22.74 12.93 43.92 coo 1.51 16.60 24.17 0.82 19.23 24.79 11.51 13.23 39.94 12.02 10.95 38.44 1a05_c01 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 3 hits 1a05_c01 naa= 3 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 64 GLU~? 15.67 O2 GOL A1148 A 60 ASP A 6 ASP.? 21.81 O2 GOL A1148 A 175 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 46.10 28.27 19.27 45.48 26.99 20.84 13.54 14.68 45.68 14.95 13.29 46.42 coo 56.42 28.06 12.93 55.01 27.92 14.50 21.58 19.24 41.26 20.54 17.38 41.15 coo 45.02 22.04 15.38 46.16 24.00 13.76 11.51 13.23 39.94 12.02 10.95 38.44 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 2 3 # 2 A 49 GLU A 80 GLU~? 13.34 C1 GOL A1147 A 60 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 175 TYR A 21 TYR~? 11.66 C1 GOL A1147 coo 46.10 28.27 19.27 45.48 26.99 20.84 7.67 8.26 27.56 9.41 8.53 26.40 coo 56.42 28.06 12.93 55.01 27.92 14.50 13.54 20.21 31.37 12.47 20.57 29.56 coo 45.02 22.04 15.38 46.16 24.00 13.76 14.72 6.39 29.44 12.13 7.41 29.50 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 3 3 # 3 A 49 GLU A 94 GLU~? 15.24 O2 SO4 A1146 A 60 ASP A 135 ASP~? 12.04 O1 GOL A1148 A 175 TYR A 129 TYR~? 7.58 O2 SO4 A1146 coo 46.10 28.27 19.27 45.48 26.99 20.84 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 56.42 28.06 12.93 55.01 27.92 14.50 0.67 3.61 47.99 2.00 2.44 49.10 coo 45.02 22.04 15.38 46.16 24.00 13.76 -3.64 -0.29 35.50 -3.07 -0.43 32.77 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 3 hits 1a50_c03 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 102 ASP~? 12.37 O2 GOL A1148 214 ASP A 6 ASP.? 21.81 O2 GOL A1148 289 ASP A 135 ASP~? 12.04 O1 GOL A1148 coo -0.62 65.95 29.97 0.31 67.47 31.05 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 26.86 59.76 46.36 25.42 58.23 45.92 21.58 19.24 41.26 20.54 17.38 41.15 coo 9.42 68.07 30.27 7.35 68.27 30.10 0.67 3.61 47.99 2.00 2.44 49.10 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 1 hits 1amy_c01 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 34 ARG.? 5.20 O3 AGOL A1147 B 342 ASP A 101 ASP~? 7.23 O3 GOL A1148 B 531 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 -0.38 -7.27 28.98 1.86 -8.15 27.08 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 B 325 ARG A 91 ARG.? 9.03 O3 AGOL A1147 B 342 ASP A 101 ASP~? 7.23 O3 GOL A1148 B 531 ARG A 34 ARG.? 5.20 O3 AGOL A1147 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 11.31 -8.21 28.23 9.62 -10.21 26.60 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 B 325 ARG A 91 ARG.? 9.03 O3 AGOL A1147 B 342 ASP A 102 ASP~? 12.37 O2 GOL A1148 B 531 ARG A 34 ARG.? 5.20 O3 AGOL A1147 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 11.31 -8.21 28.23 9.62 -10.21 26.60 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 3 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 34 ARG.? 5.20 O3 AGOL A1147 A 342 ASP A 101 ASP~? 7.23 O3 GOL A1148 A 531 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -0.38 -7.27 28.98 1.86 -8.15 27.08 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 A 325 ARG A 77 ARG~? 14.83 O1 GOL A1147 A 342 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 531 ARG A 29 ARG~? 10.10 O3 BGOL A1147 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 13.84 10.22 30.84 16.69 9.80 29.81 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -0.83 10.88 33.15 0.71 12.12 33.87 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 7.64 2.56 22.30 9.21 4.89 21.02 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 A 325 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 342 ASP A 101 ASP~? 7.23 O3 GOL A1148 A 531 ARG A 34 ARG.? 5.20 O3 AGOL A1147 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 11.31 -8.21 28.23 9.62 -10.21 26.60 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 A 325 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 342 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 531 ARG A 34 ARG.? 5.20 O3 AGOL A1147 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 11.31 -8.21 28.23 9.62 -10.21 26.60 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 4 hits 1asy_c01 naa= 3 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 1 3 # 1 A 85 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 171 ARG A 46 ARG.? 13.13 O2 GOL A1148 A 190 LYS A 11 LYS~? 21.22 O2 GOL A1148 coo 22.59 2.26 43.22 21.17 3.47 42.27 15.28 17.18 36.03 17.14 16.78 35.14 coo 13.63 3.81 28.83 14.49 2.91 31.59 15.67 8.12 51.97 17.20 9.77 49.88 coo 24.97 7.47 37.69 21.24 10.69 35.89 21.22 13.78 38.77 26.11 13.41 41.35 1azy_c00 source 1azy THYMIDINE PHOSPHORYLASE : 1 hits 1azy_c00 naa= 3 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 1 3 # 1 B 85 HIS A 71 HIS~? 22.50 O2 GOL A1148 B 171 ARG A 46 ARG.? 13.13 O2 GOL A1148 B 190 LYS A 11 LYS~? 21.22 O2 GOL A1148 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 15.28 17.18 36.03 17.14 16.78 35.14 coo 2.83 4.83 10.84 1.96 4.32 7.97 15.67 8.12 51.97 17.20 9.77 49.88 coo -8.96 9.04 2.88 -5.39 12.11 5.08 21.22 13.78 38.77 26.11 13.41 41.35 1azy_c01 source 1azy THYMIDINE PHOSPHORYLASE : 1 hits 1azy_c01 naa= 3 ULMN 3 1b02_c01 THYMIDYLATE SYNTHASE user 1 3 # 1 A 161 CYH A 81 CYH~? 12.40 C1 GOL A1147 A 192 ASN A 86 ASN~? -7.27 O3 SO4 A1146s A 195 GLN A 87 GLN~? 8.34 O4 SO4 A1146 coo -2.78 50.68 10.78 -4.68 50.49 8.71 6.31 6.18 31.19 9.06 5.87 31.56 coo -0.10 43.44 8.03 -1.33 45.05 7.36 -2.38 5.31 30.77 -2.40 5.93 32.80 coo 3.53 43.81 4.75 2.30 45.38 4.00 -1.27 3.40 24.46 0.26 4.34 23.32 1b02_c01 source 1b02 THYMIDYLATE SYNTHASE : 1 hits 1b02_c01 naa= 3 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 A 109 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 182 GLU A 80 GLU~? 13.34 C1 GOL A1147 A 286 ASN A 86 ASN~? -7.27 O3 SO4 A1146s coo 26.03 44.66 108.90 25.67 42.61 108.82 -0.83 10.88 33.15 0.71 12.12 33.87 coo 18.06 44.02 105.38 18.08 45.37 107.03 7.67 8.26 27.56 9.41 8.53 26.40 coo 25.47 38.28 112.06 27.26 39.30 111.54 -2.38 5.31 30.77 -2.40 5.93 32.80 1b57_c00 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 1 hits 1b57_c00 naa= 3 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 B 109 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 182 GLU A 80 GLU~? 13.34 C1 GOL A1147 B 286 ASN A 86 ASN~? -7.27 O3 SO4 A1146s coo 13.82 69.26 132.27 11.87 70.14 132.51 -0.83 10.88 33.15 0.71 12.12 33.87 coo 8.74 63.05 136.42 9.87 62.19 134.79 7.67 8.26 27.56 9.41 8.53 26.40 coo 8.26 72.60 129.22 10.14 73.45 129.80 -2.38 5.31 30.77 -2.40 5.93 32.80 1b57_c01 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 1 hits 1b57_c01 naa= 3 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 A 145 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 230 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 273 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 9.23 21.44 106.88 10.18 19.34 105.31 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 1.45 22.80 104.16 2.58 21.02 104.01 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 2.97 11.64 107.87 6.59 15.13 107.03 8.51 -4.81 32.23 11.26 -4.33 37.14 1b8g_c04 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 1 hits 1b8g_c04 naa= 3 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 B 145 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 230 ASP A 102 ASP~? 12.37 O2 GOL A1148 B 273 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 11.81 13.41 73.03 10.00 13.03 75.12 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 19.17 11.01 76.14 17.26 10.42 76.77 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 11.10 2.31 76.60 10.24 7.24 75.62 8.51 -4.81 32.23 11.26 -4.33 37.14 1b8g_c05 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 1 hits 1b8g_c05 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 114 ARG~? 22.43 O3 SO4 A1146 A 141 THR A 138 THR~? 13.50 O2 GOL A1148 A 235 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo 6.21 93.81 36.58 4.58 96.33 37.17 -2.08 13.07 47.90 -4.47 12.15 49.60 coo 6.80 92.87 28.33 4.91 92.74 27.40 2.60 6.80 51.03 3.21 6.96 48.95 coo 12.98 90.36 47.57 11.26 89.62 46.62 -0.83 10.88 33.15 0.71 12.12 33.87 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 114 ARG~? 22.43 O3 SO4 A1146 C 141 THR A 138 THR~? 13.50 O2 GOL A1148 C 235 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -2.08 13.07 47.90 -4.47 12.15 49.60 coo -6.81 68.31 28.28 -4.82 68.47 27.57 2.60 6.80 51.03 3.21 6.96 48.95 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -0.83 10.88 33.15 0.71 12.12 33.87 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c02 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 121 ASP~? 13.01 O3 SO4 A1146 16 HIS A 79 HIS~? 16.50 O3 SO4 A1146 67 GLY A 35 GLY.? 6.43 O1 GOL A1147 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -0.83 10.88 33.15 0.71 12.12 33.87 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 4.14 13.68 32.87 3.48 14.92 34.43 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 14.58 -5.00 33.19 13.93 -5.02 33.65 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP A 121 ASP~? 13.01 O3 SO4 A1146 16 HIS A 79 HIS~? 16.50 O3 SO4 A1146 67 GLY A 58 GLY.? 9.16 O2 GOL A1148 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -0.83 10.88 33.15 0.71 12.12 33.87 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 4.14 13.68 32.87 3.48 14.92 34.43 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 13.89 6.85 47.31 14.44 7.38 46.94 1be1_c02 source 1be1 GLUTAMATE MUTASE : 2 hits 1be1_c02 naa= 3 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 # 1 B 451 GLU A 27 GLU~? -3.67 O1 GOL A1147s B 504 TYR A 21 TYR~? 11.66 C1 GOL A1147 B 540 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 86.52 35.28 112.74 87.08 36.38 110.99 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 84.93 40.21 105.31 85.72 41.45 107.72 14.72 6.39 29.44 12.13 7.41 29.50 coo 83.38 41.19 112.55 85.47 40.59 112.72 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 2 3 # 2 B 451 GLU A 95 GLU~? 13.83 O2 SO4 A1146 B 504 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 540 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo 86.52 35.28 112.74 87.08 36.38 110.99 -1.34 -10.20 33.52 -3.07 -10.54 32.36 coo 84.93 40.21 105.31 85.72 41.45 107.72 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 83.38 41.19 112.55 85.47 40.59 112.72 -0.81 -7.81 39.86 -2.88 -7.29 39.80 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 32 ARG.? 8.17 O3 AGOL A1147 A 451 GLU A 94 GLU~? 15.24 O2 SO4 A1146 A 540 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 79.04 80.20 80.81 79.58 81.40 83.63 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 81.34 87.29 87.22 82.36 86.09 88.61 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 79.94 80.46 88.84 81.11 81.36 87.27 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 29 ARG~? 10.10 O3 BGOL A1147 B 451 GLU A 27 GLU~? -3.67 O1 GOL A1147s B 540 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 82.21 41.07 119.14 83.95 40.66 116.59 7.64 2.56 22.30 9.21 4.89 21.02 coo 86.52 35.28 112.74 87.08 36.38 110.99 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 83.38 41.19 112.55 85.47 40.59 112.72 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 # 2 B 382 ARG A 91 ARG.? 9.03 O3 AGOL A1147 B 451 GLU A 94 GLU~? 15.24 O2 SO4 A1146 B 540 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 82.21 41.07 119.14 83.95 40.66 116.59 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 86.52 35.28 112.74 87.08 36.38 110.99 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 83.38 41.19 112.55 85.47 40.59 112.72 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c05 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG A 56 ARG~? 10.90 O2 GOL A1148 183 LYS A 11 LYS~? 21.22 O2 GOL A1148 317 ARG A 22 ARG~? 9.54 O3 BGOL A1147 coo 76.57 109.19 73.41 73.86 110.26 72.16 22.32 4.42 45.18 23.04 1.62 46.30 coo 82.09 117.51 66.37 80.60 114.32 71.44 21.22 13.78 38.77 26.11 13.41 41.35 coo 65.21 120.62 58.76 63.62 123.14 59.66 14.87 3.60 22.71 13.15 4.40 20.32 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 2 3 # 2 118 ARG A 137 ARG~? 7.86 O1 GOL A1148 183 LYS A 104 LYS~? -2.54 O2 GOL A1148s 317 ARG A 12 ARG~? 14.35 O2 GOL A1148 coo 76.57 109.19 73.41 73.86 110.26 72.16 3.45 0.43 53.78 6.50 0.05 53.66 coo 82.09 117.51 66.37 80.60 114.32 71.44 6.01 0.08 43.69 10.87 -1.21 45.63 coo 65.21 120.62 58.76 63.62 123.14 59.66 19.79 9.88 44.03 17.28 11.31 45.11 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 3 3 # 3 118 ARG A 137 ARG~? 7.86 O1 GOL A1148 183 LYS A 104 LYS~? -2.54 O2 GOL A1148s 317 ARG A 56 ARG~? 10.90 O2 GOL A1148 coo 76.57 109.19 73.41 73.86 110.26 72.16 3.45 0.43 53.78 6.50 0.05 53.66 coo 82.09 117.51 66.37 80.60 114.32 71.44 6.01 0.08 43.69 10.87 -1.21 45.63 coo 65.21 120.62 58.76 63.62 123.14 59.66 22.32 4.42 45.18 23.04 1.62 46.30 1bib_c00 source 1bib BIRA BIFUNCTIONAL PROTEIN (ACTS AS BIOTIN OPER: 3 hits 1bib_c00 naa= 3 ULMN 3 1bqc_c01 BETA-MANNANASE user 1 3 # 1 A 50 ARG A 22 ARG~? 9.54 O3 BGOL A1147 A 128 GLU A 27 GLU~? -3.67 O1 GOL A1147s A 225 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 38.56 19.11 14.83 37.12 21.00 16.76 14.87 3.60 22.71 13.15 4.40 20.32 coo 36.48 24.43 22.02 36.86 26.34 21.13 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 40.16 23.71 17.01 38.52 24.96 17.40 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1bqc_c01 BETA-MANNANASE user 2 3 # 2 A 50 ARG A 29 ARG~? 10.10 O3 BGOL A1147 A 128 GLU A 27 GLU~? -3.67 O1 GOL A1147s A 225 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 38.56 19.11 14.83 37.12 21.00 16.76 7.64 2.56 22.30 9.21 4.89 21.02 coo 36.48 24.43 22.02 36.86 26.34 21.13 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 40.16 23.71 17.01 38.52 24.96 17.40 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1bqc_c01 BETA-MANNANASE user 3 3 # 3 A 50 ARG A 34 ARG.? 5.20 O3 AGOL A1147 A 128 GLU A 26 GLU~? -5.34 O3 BGOL A1147s A 225 GLU A 27 GLU~? -3.67 O1 GOL A1147s coo 38.56 19.11 14.83 37.12 21.00 16.76 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 36.48 24.43 22.02 36.86 26.34 21.13 12.58 -0.11 23.07 11.74 0.33 21.17 coo 40.16 23.71 17.01 38.52 24.96 17.40 11.27 -3.81 28.47 12.69 -3.93 29.99 ULMN 3 1bqc_c01 BETA-MANNANASE user 4 3 # 4 A 50 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 128 GLU A 94 GLU~? 15.24 O2 SO4 A1146 A 225 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 38.56 19.11 14.83 37.12 21.00 16.76 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 36.48 24.43 22.02 36.86 26.34 21.13 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 40.16 23.71 17.01 38.52 24.96 17.40 -1.34 -10.20 33.52 -3.07 -10.54 32.36 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 36 HIS.? 9.89 O3 GOL A1148 A 168 ARG A 22 ARG~? 9.54 O3 BGOL A1147 A 187 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 62.47 12.00 59.65 61.76 10.14 60.31 17.26 -6.17 36.90 17.14 -8.26 36.70 coo 55.10 8.37 73.00 55.48 9.59 70.20 14.87 3.60 22.71 13.15 4.40 20.32 coo 66.76 10.09 66.23 61.80 8.06 65.82 8.51 -4.81 32.23 11.26 -4.33 37.14 1brw_c00 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 1 hits 1brw_c00 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE A 97 PHE~? 12.37 O3 AGOL A1147 A 205 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 236 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 4.14 2.10 36.34 6.69 3.08 36.92 4.68 -2.71 36.32 5.13 -0.43 34.81 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 -0.83 10.88 33.15 0.71 12.12 33.87 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 2 3 # 2 A 109 PHE A 122 PHE~? 15.53 O3 SO4 A1146 A 205 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 236 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 4.14 2.10 36.34 6.69 3.08 36.92 1.00 11.08 38.09 3.27 12.41 37.09 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 -7.58 2.17 35.54 -5.66 0.99 29.63 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 2 hits 1bs0_c01 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 66 GLN~? 24.06 O2 GOL A1148 A 91 LEU A 62 LEU~? 20.40 O2 GOL A1148 A 133 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 43.58 43.67 66.73 42.32 42.78 68.15 6.14 19.17 44.53 5.32 20.59 45.87 coo 38.58 45.09 70.44 38.28 45.21 72.59 5.72 16.45 49.15 3.81 16.35 48.07 coo 44.05 36.87 70.65 43.15 38.64 69.97 13.54 14.68 45.68 14.95 13.29 46.42 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 66 GLN~? 24.06 O2 GOL A1148 A 91 LEU A 69 LEU~? 21.16 O2 GOL A1148 A 133 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 43.58 43.67 66.73 42.32 42.78 68.15 6.14 19.17 44.53 5.32 20.59 45.87 coo 38.58 45.09 70.44 38.28 45.21 72.59 7.13 17.02 38.68 5.65 15.48 38.95 coo 44.05 36.87 70.65 43.15 38.64 69.97 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN A 66 GLN~? 24.06 O2 GOL A1148 A 91 LEU A 69 LEU~? 21.16 O2 GOL A1148 A 133 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 43.58 43.67 66.73 42.32 42.78 68.15 6.14 19.17 44.53 5.32 20.59 45.87 coo 38.58 45.09 70.44 38.28 45.21 72.59 7.13 17.02 38.68 5.65 15.48 38.95 coo 44.05 36.87 70.65 43.15 38.64 69.97 13.54 14.68 45.68 14.95 13.29 46.42 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 3 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 66 GLN~? 24.06 O2 GOL A1148 B 591 LEU A 62 LEU~? 20.40 O2 GOL A1148 B 633 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 88.06 44.34 57.19 89.06 45.53 55.74 6.14 19.17 44.53 5.32 20.59 45.87 coo 86.70 48.66 52.61 87.15 48.69 50.51 5.72 16.45 49.15 3.81 16.35 48.07 coo 95.42 44.52 54.43 93.46 45.31 54.70 13.54 14.68 45.68 14.95 13.29 46.42 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN A 66 GLN~? 24.06 O2 GOL A1148 B 591 LEU A 69 LEU~? 21.16 O2 GOL A1148 B 633 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 88.06 44.34 57.19 89.06 45.53 55.74 6.14 19.17 44.53 5.32 20.59 45.87 coo 86.70 48.66 52.61 87.15 48.69 50.51 7.13 17.02 38.68 5.65 15.48 38.95 coo 95.42 44.52 54.43 93.46 45.31 54.70 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 3 3 # 3 B 550 GLN A 66 GLN~? 24.06 O2 GOL A1148 B 591 LEU A 69 LEU~? 21.16 O2 GOL A1148 B 633 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 88.06 44.34 57.19 89.06 45.53 55.74 6.14 19.17 44.53 5.32 20.59 45.87 coo 86.70 48.66 52.61 87.15 48.69 50.51 7.13 17.02 38.68 5.65 15.48 38.95 coo 95.42 44.52 54.43 93.46 45.31 54.70 13.54 14.68 45.68 14.95 13.29 46.42 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 3 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 66 GLN~? 24.06 O2 GOL A1148 C1091 LEU A 62 LEU~? 20.40 O2 GOL A1148 C1133 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 68.29 34.44 43.03 66.67 34.74 44.37 6.14 19.17 44.53 5.32 20.59 45.87 coo 65.83 38.95 47.05 65.46 38.90 49.20 5.72 16.45 49.15 3.81 16.35 48.07 coo 63.14 29.39 46.25 63.84 31.31 45.74 13.54 14.68 45.68 14.95 13.29 46.42 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN A 66 GLN~? 24.06 O2 GOL A1148 C1091 LEU A 69 LEU~? 21.16 O2 GOL A1148 C1133 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 68.29 34.44 43.03 66.67 34.74 44.37 6.14 19.17 44.53 5.32 20.59 45.87 coo 65.83 38.95 47.05 65.46 38.90 49.20 7.13 17.02 38.68 5.65 15.48 38.95 coo 63.14 29.39 46.25 63.84 31.31 45.74 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 3 3 # 3 C1050 GLN A 66 GLN~? 24.06 O2 GOL A1148 C1091 LEU A 69 LEU~? 21.16 O2 GOL A1148 C1133 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 68.29 34.44 43.03 66.67 34.74 44.37 6.14 19.17 44.53 5.32 20.59 45.87 coo 65.83 38.95 47.05 65.46 38.90 49.20 7.13 17.02 38.68 5.65 15.48 38.95 coo 63.14 29.39 46.25 63.84 31.31 45.74 13.54 14.68 45.68 14.95 13.29 46.42 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 3 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 66 GLN~? 24.06 O2 GOL A1148 A 91 LEU A 62 LEU~? 20.40 O2 GOL A1148 A 133 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 38.23 53.34 67.59 38.84 53.87 69.56 6.14 19.17 44.53 5.32 20.59 45.87 coo 35.40 53.22 73.30 35.37 54.87 74.74 5.72 16.45 49.15 3.81 16.35 48.07 coo 45.08 56.04 70.60 43.15 55.19 70.77 13.54 14.68 45.68 14.95 13.29 46.42 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 66 GLN~? 24.06 O2 GOL A1148 A 91 LEU A 69 LEU~? 21.16 O2 GOL A1148 A 133 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 38.23 53.34 67.59 38.84 53.87 69.56 6.14 19.17 44.53 5.32 20.59 45.87 coo 35.40 53.22 73.30 35.37 54.87 74.74 7.13 17.02 38.68 5.65 15.48 38.95 coo 45.08 56.04 70.60 43.15 55.19 70.77 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN A 66 GLN~? 24.06 O2 GOL A1148 A 91 LEU A 69 LEU~? 21.16 O2 GOL A1148 A 133 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 38.23 53.34 67.59 38.84 53.87 69.56 6.14 19.17 44.53 5.32 20.59 45.87 coo 35.40 53.22 73.30 35.37 54.87 74.74 7.13 17.02 38.68 5.65 15.48 38.95 coo 45.08 56.04 70.60 43.15 55.19 70.77 13.54 14.68 45.68 14.95 13.29 46.42 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 3 hits 1bsj_c00 naa= 3 ULMN 3 1bwd_c02 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 # 1 A 179 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 227 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 332 CYH A 81 CYH~? 12.40 C1 GOL A1147 coo 123.98 30.59 1.90 124.68 28.67 1.28 -0.83 10.88 33.15 0.71 12.12 33.87 coo 119.16 28.51 2.63 120.67 28.31 1.13 4.14 13.68 32.87 3.48 14.92 34.43 coo 114.70 31.13 -3.42 115.96 29.28 -1.69 6.31 6.18 31.19 9.06 5.87 31.56 1bwd_c02 source 1bwd INOSAMINE-PHOSPHATE AMIDINOTRANSFERASE : 1 hits 1bwd_c02 naa= 3 ULMN 3 1bwd_c03 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 # 1 B 179 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 227 HIS A 79 HIS~? 16.50 O3 SO4 A1146 B 332 CYH A 81 CYH~? 12.40 C1 GOL A1147 coo 94.18 76.57 24.23 93.74 77.97 22.66 -0.83 10.88 33.15 0.71 12.12 33.87 coo 89.34 74.44 23.40 90.11 76.41 23.55 4.14 13.68 32.87 3.48 14.92 34.43 coo 85.03 76.39 29.77 85.85 76.14 27.06 6.31 6.18 31.19 9.06 5.87 31.56 1bwd_c03 source 1bwd INOSAMINE-PHOSPHATE AMIDINOTRANSFERASE : 1 hits 1bwd_c03 naa= 3 ULMN 3 1c2t_c02 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 # 1 A 106 ASN A 119 ASN~? 16.25 O3 SO4 A1146 A 108 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 144 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo 16.88 2.43 18.09 16.20 3.65 19.72 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 16.00 9.54 19.61 16.53 10.80 21.20 4.14 13.68 32.87 3.48 14.92 34.43 coo 20.15 8.89 19.42 18.82 8.12 20.82 -0.83 10.88 33.15 0.71 12.12 33.87 1c2t_c02 source 1c2t GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE : 1 hits 1c2t_c02 naa= 3 ULMN 3 1c2t_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 # 1 B 106 ASN A 119 ASN~? 16.25 O3 SO4 A1146 B 108 HIS A 79 HIS~? 16.50 O3 SO4 A1146 B 144 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo 35.24 22.62 -1.00 36.98 21.40 -1.03 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 37.11 15.55 -1.20 38.41 14.30 -0.14 4.14 13.68 32.87 3.48 14.92 34.43 coo 35.12 16.22 2.69 37.05 17.04 2.40 -0.83 10.88 33.15 0.71 12.12 33.87 1c2t_c03 source 1c2t GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE : 1 hits 1c2t_c03 naa= 3 ULMN 3 1c82_c01 HYALURONATE LYASE user 1 3 # 1 A 399 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 408 TYR A 68 TYR~? 16.26 O2 GOL A1148 A 462 ARG A 77 ARG~? 14.83 O1 GOL A1147 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 15.28 17.18 36.03 17.14 16.78 35.14 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 11.51 13.23 39.94 12.02 10.95 38.44 coo 10.34 -11.56 38.02 10.61 -11.96 35.00 13.84 10.22 30.84 16.69 9.80 29.81 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 71 HIS~? 22.50 O2 GOL A1148 A 408 TYR A 68 TYR~? 16.26 O2 GOL A1148 A 480 ARG A 114 ARG~? 22.43 O3 SO4 A1146 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 15.28 17.18 36.03 17.14 16.78 35.14 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 11.51 13.23 39.94 12.02 10.95 38.44 coo -6.46 -13.31 26.85 -4.21 -11.25 27.13 -2.08 13.07 47.90 -4.47 12.15 49.60 1c82_c02 source 1c82 HYALURONATE LYASE : 1 hits 1c82_c02 naa= 3 ULMN 3 1cb8_c01 CHONDROITINASE AC user 1 3 # 1 A 225 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 234 TYR A 68 TYR~? 16.26 O2 GOL A1148 A 288 ARG A 77 ARG~? 14.83 O1 GOL A1147 coo 27.04 28.61 41.75 26.86 28.65 43.84 15.28 17.18 36.03 17.14 16.78 35.14 coo 21.80 30.48 43.67 23.70 29.06 45.12 11.51 13.23 39.94 12.02 10.95 38.44 coo 24.79 22.62 45.60 24.87 25.42 46.81 13.84 10.22 30.84 16.69 9.80 29.81 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 32 ARG.? 8.17 O3 AGOL A1147 127 ARG A 91 ARG.? 9.03 O3 AGOL A1147 270 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo -0.83 25.63 1.57 0.97 28.05 0.90 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 -0.81 -7.81 39.86 -2.88 -7.29 39.80 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 2 3 # 2 71 ARG A 91 ARG.? 9.03 O3 AGOL A1147 127 ARG A 32 ARG.? 8.17 O3 AGOL A1147 270 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo -0.83 25.63 1.57 0.97 28.05 0.90 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 5.64 -9.61 30.19 6.78 -11.86 28.47 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 -0.81 -7.81 39.86 -2.88 -7.29 39.80 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 3 3 # 3 71 ARG A 137 ARG~? 7.86 O1 GOL A1148 127 ARG A 136 ARG~? 19.45 O1 GOL A1148 270 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -0.83 25.63 1.57 0.97 28.05 0.90 3.45 0.43 53.78 6.50 0.05 53.66 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 -3.07 1.25 54.96 -5.99 1.43 53.92 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 -4.46 7.21 46.33 -4.54 9.09 47.28 1cbx_c01 source 1cbx CARBOXYPEPTIDASE A (E.C.3.4.17.1) COMPLEX WITH: 3 hits 1cbx_c01 naa= 3 ULMN 3 1cde_c04 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 # 1 106 ASN A 119 ASN~? 16.25 O3 SO4 A1146 108 HIS A 79 HIS~? 16.50 O3 SO4 A1146 144 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo -1.10 -5.24 -0.75 -0.59 -6.18 1.17 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 2.74 -10.94 1.41 2.75 -12.60 2.56 4.14 13.68 32.87 3.48 14.92 34.43 coo -0.94 -12.96 0.04 -1.03 -11.72 1.73 -0.83 10.88 33.15 0.71 12.12 33.87 1cde_c04 source 1cde PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANSFERASE : 1 hits 1cde_c04 naa= 3 ULMN 3 1cde_c05 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 # 1 106 ASN A 119 ASN~? 16.25 O3 SO4 A1146 108 HIS A 79 HIS~? 16.50 O3 SO4 A1146 144 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo -1.10 -5.24 -0.75 -0.59 -6.18 1.17 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 2.74 -10.94 1.41 2.75 -12.60 2.56 4.14 13.68 32.87 3.48 14.92 34.43 coo -0.94 -12.96 0.04 -1.03 -11.72 1.73 -0.83 10.88 33.15 0.71 12.12 33.87 1cde_c05 source 1cde PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANSFERASE : 1 hits 1cde_c05 naa= 3 ULMN 3 1cde_c06 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 # 1 106 ASN A 119 ASN~? 16.25 O3 SO4 A1146 108 HIS A 79 HIS~? 16.50 O3 SO4 A1146 144 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo -1.10 -5.24 -0.75 -0.59 -6.18 1.17 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 2.74 -10.94 1.41 2.75 -12.60 2.56 4.14 13.68 32.87 3.48 14.92 34.43 coo -0.94 -12.96 0.04 -1.03 -11.72 1.73 -0.83 10.88 33.15 0.71 12.12 33.87 1cde_c06 source 1cde PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANSFERASE : 1 hits 1cde_c06 naa= 3 ULMN 3 1cde_c07 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 # 1 106 ASN A 119 ASN~? 16.25 O3 SO4 A1146 108 HIS A 79 HIS~? 16.50 O3 SO4 A1146 144 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo -1.10 -5.24 -0.75 -0.59 -6.18 1.17 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 2.74 -10.94 1.41 2.75 -12.60 2.56 4.14 13.68 32.87 3.48 14.92 34.43 coo -0.94 -12.96 0.04 -1.03 -11.72 1.73 -0.83 10.88 33.15 0.71 12.12 33.87 1cde_c07 source 1cde PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANSFERASE : 1 hits 1cde_c07 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 173 ASP A 102 ASP~? 12.37 O2 GOL A1148 C 48 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 24.35 4.55 25.11 25.94 3.23 25.53 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -0.38 -7.27 28.98 1.86 -8.15 27.08 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 91 ARG.? 9.03 O3 AGOL A1147 C 101 TYR A 129 TYR~? 7.58 O2 SO4 A1146 C 173 ASP A 102 ASP~? 12.37 O2 GOL A1148 coo 32.27 5.62 48.15 31.93 6.48 51.06 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 29.64 3.64 57.39 31.22 5.14 55.65 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 1.78 -4.59 40.98 1.81 -5.91 42.65 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 91 ARG.? 9.03 O3 AGOL A1147 D 101 TYR A 129 TYR~? 7.58 O2 SO4 A1146 D 173 ASP A 102 ASP~? 12.37 O2 GOL A1148 coo 69.08 8.58 32.60 69.70 10.81 30.58 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 71.77 11.86 24.26 70.23 12.22 26.56 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 71.60 6.14 19.25 70.26 6.87 20.69 1.78 -4.59 40.98 1.81 -5.91 42.65 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 173 ASP A 102 ASP~? 12.37 O2 GOL A1148 D 48 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -0.38 -7.27 28.98 1.86 -8.15 27.08 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c03 naa= 3 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 # 1 A 1 ALA A 124 ALA~? 7.24 O3 SO4 A1146 A 74 ASN A 86 ASN~? -7.27 O3 SO4 A1146s A 75 GLY A 83 GLY~? 9.44 O4 SO4 A1146 coo -1.80 62.71 122.76 -1.88 63.70 123.92 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 1.20 66.40 122.20 2.03 64.53 121.46 -2.38 5.31 30.77 -2.40 5.93 32.80 coo 4.68 65.84 125.52 4.11 65.60 126.05 1.28 7.34 29.60 1.75 6.71 29.80 1ct9_c04 source 1ct9 ASPARAGINE SYNTHETASE B : 1 hits 1ct9_c04 naa= 3 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 # 1 B 1 ALA A 124 ALA~? 7.24 O3 SO4 A1146 B 74 ASN A 86 ASN~? -7.27 O3 SO4 A1146s B 75 GLY A 83 GLY~? 9.44 O4 SO4 A1146 coo 39.21 14.97 27.55 40.19 16.01 27.08 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 43.06 12.94 25.74 42.26 11.81 27.44 -2.38 5.31 30.77 -2.40 5.93 32.80 coo 46.38 13.54 29.18 46.14 14.29 29.26 1.28 7.34 29.60 1.75 6.71 29.80 1ct9_c05 source 1ct9 ASPARAGINE SYNTHETASE B : 1 hits 1ct9_c05 naa= 3 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 # 1 C 1 ALA A 124 ALA~? 7.24 O3 SO4 A1146 C 74 ASN A 86 ASN~? -7.27 O3 SO4 A1146s C 75 GLY A 83 GLY~? 9.44 O4 SO4 A1146 coo 16.14 15.08 36.63 15.28 14.65 37.81 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 11.60 16.13 36.70 12.80 17.74 35.96 -2.38 5.31 30.77 -2.40 5.93 32.80 coo 10.99 19.23 40.32 11.50 18.77 40.74 1.28 7.34 29.60 1.75 6.71 29.80 1ct9_c06 source 1ct9 ASPARAGINE SYNTHETASE B : 1 hits 1ct9_c06 naa= 3 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 # 1 D 1 ALA A 124 ALA~? 7.24 O3 SO4 A1146 D 74 ASN A 86 ASN~? -7.27 O3 SO4 A1146s D 75 GLY A 83 GLY~? 9.44 O4 SO4 A1146 coo -13.31 41.90 116.45 -13.05 40.39 116.25 -5.77 7.91 35.54 -5.54 8.44 34.13 coo -16.85 39.36 115.26 -17.55 40.58 116.90 -2.38 5.31 30.77 -2.40 5.93 32.80 coo -17.65 36.37 119.00 -16.85 36.22 119.00 1.28 7.34 29.60 1.75 6.71 29.80 1ct9_c07 source 1ct9 ASPARAGINE SYNTHETASE B : 1 hits 1ct9_c07 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 56 ILE A 59 ILE.? 13.51 O2 GOL A1148 A 82 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 21.37 14.29 44.78 22.74 12.93 43.92 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 11.00 10.62 46.36 11.27 11.63 45.26 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 11.51 13.23 39.94 12.02 10.95 38.44 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 1 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 56 ILE A 59 ILE.? 13.51 O2 GOL A1148 B 82 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 21.37 14.29 44.78 22.74 12.93 43.92 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 11.00 10.62 46.36 11.27 11.63 45.26 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 11.51 13.23 39.94 12.02 10.95 38.44 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 1 hits 1d6o_c01 naa= 3 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 173 TYR A 57 TYR~? 10.51 O2 GOL A1148 A 243 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 272 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 2.03 68.31 21.46 0.66 68.36 23.90 17.76 5.01 42.82 20.23 4.84 41.52 coo 16.93 55.67 9.65 17.16 54.23 11.19 -0.83 10.88 33.15 0.71 12.12 33.87 coo 14.13 45.79 13.40 14.25 49.41 18.30 -7.58 2.17 35.54 -5.66 0.99 29.63 1d7r_c02 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 1 hits 1d7r_c02 naa= 3 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 A 145 LYS A 11 LYS~? 21.22 O2 GOL A1148 A 177 GLU A 64 GLU~? 15.67 O2 GOL A1148 A 201 LEU A 10 LEU~? 19.34 O2 GOL A1148 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 21.22 13.78 38.77 26.11 13.41 41.35 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 13.54 14.68 45.68 14.95 13.29 46.42 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 17.23 15.55 40.31 15.32 16.09 41.22 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 A 145 LYS A 128 LYS~? -2.87 O2 SO4 A1146s A 177 GLU A 134 GLU.? 19.30 O3 SO4 A1146 A 201 LEU A 126 LEU~? 13.42 O3 SO4 A1146 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 -7.58 2.17 35.54 -5.66 0.99 29.63 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 -4.46 7.21 46.33 -4.54 9.09 47.28 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 -4.50 5.51 40.83 -2.73 5.70 42.15 1daa_c00 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c00 naa= 3 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 B 145 LYS A 11 LYS~? 21.22 O2 GOL A1148 B 177 GLU A 64 GLU~? 15.67 O2 GOL A1148 B 201 LEU A 10 LEU~? 19.34 O2 GOL A1148 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 21.22 13.78 38.77 26.11 13.41 41.35 coo 27.00 6.35 51.01 26.30 4.53 50.18 13.54 14.68 45.68 14.95 13.29 46.42 coo 23.74 1.68 49.50 22.87 -0.24 49.97 17.23 15.55 40.31 15.32 16.09 41.22 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 B 145 LYS A 128 LYS~? -2.87 O2 SO4 A1146s B 177 GLU A 134 GLU.? 19.30 O3 SO4 A1146 B 201 LEU A 126 LEU~? 13.42 O3 SO4 A1146 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 -7.58 2.17 35.54 -5.66 0.99 29.63 coo 27.00 6.35 51.01 26.30 4.53 50.18 -4.46 7.21 46.33 -4.54 9.09 47.28 coo 23.74 1.68 49.50 22.87 -0.24 49.97 -4.50 5.51 40.83 -2.73 5.70 42.15 1daa_c01 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c01 naa= 3 ULMN 3 1dhp_c00 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 A 133 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 138 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 161 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 29.03 88.95 86.80 28.09 90.57 84.75 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 23.31 93.18 82.88 23.00 93.71 79.86 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 33.83 91.15 88.62 31.07 91.06 83.02 -7.58 2.17 35.54 -5.66 0.99 29.63 1dhp_c00 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 1 hits 1dhp_c00 naa= 3 ULMN 3 1dhp_c01 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 B 133 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 138 ARG A 91 ARG.? 9.03 O3 AGOL A1147 B 161 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 4.62 122.69 99.88 5.46 122.82 97.24 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 10.44 122.27 94.08 11.02 123.87 91.53 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo -0.17 119.75 99.65 2.51 123.83 95.70 -7.58 2.17 35.54 -5.66 0.99 29.63 1dhp_c01 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 1 hits 1dhp_c01 naa= 3 ULMN 3 1din_c00 DIENELACTONE HYDROLASE user 1 3 # 1 123 CYH A 81 CYH~? 12.40 C1 GOL A1147 171 ASP A 121 ASP~? 13.01 O3 SO4 A1146 202 HIS A 79 HIS~? 16.50 O3 SO4 A1146 coo 13.53 50.63 6.92 14.43 49.91 4.38 6.31 6.18 31.19 9.06 5.87 31.56 coo 11.86 58.52 0.90 11.25 56.63 1.71 -0.83 10.88 33.15 0.71 12.12 33.87 coo 12.37 53.26 1.34 11.86 52.62 3.19 4.14 13.68 32.87 3.48 14.92 34.43 1din_c00 source 1din DIENELACTONE HYDROLASE : 1 hits 1din_c00 naa= 3 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 # 1 B 141 GLY A 98 GLY.? 12.12 O3 GOL A1148 B 144 GLU A 94 GLU~? 15.24 O2 SO4 A1146 B 164 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 88.87 114.43 152.30 88.45 115.15 152.32 5.16 -8.51 38.23 5.32 -7.71 38.47 coo 85.20 111.99 152.05 86.60 110.89 150.91 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 88.14 113.46 145.73 86.79 113.92 147.30 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1dub_c13 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c13 naa= 3 ULMN 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 # 1 C 141 GLY A 98 GLY.? 12.12 O3 GOL A1148 C 144 GLU A 94 GLU~? 15.24 O2 SO4 A1146 C 164 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 56.28 104.55 135.84 56.09 105.34 136.05 5.16 -8.51 38.23 5.32 -7.71 38.47 coo 58.46 103.90 139.48 57.57 102.00 139.16 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 51.71 102.03 140.09 53.02 103.62 140.54 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1dub_c14 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c14 naa= 3 ULMN 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 # 1 D 141 GLY A 98 GLY.? 12.12 O3 GOL A1148 D 144 GLU A 94 GLU~? 15.24 O2 SO4 A1146 D 164 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 86.19 80.64 132.77 86.38 79.85 132.93 5.16 -8.51 38.23 5.32 -7.71 38.47 coo 84.75 81.24 136.88 85.62 83.14 136.43 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 91.47 83.05 136.24 90.35 81.38 136.84 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1dub_c15 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c15 naa= 3 ULMN 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 # 1 F 141 GLY A 98 GLY.? 12.12 O3 GOL A1148 F 144 GLU A 94 GLU~? 15.24 O2 SO4 A1146 F 164 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 57.12 70.68 155.10 57.52 69.95 155.02 5.16 -8.51 38.23 5.32 -7.71 38.47 coo 60.62 73.13 154.21 59.05 74.26 153.35 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 56.75 71.71 148.46 58.44 71.01 149.54 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1dub_c17 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c17 naa= 3 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 1 3 # 1 A 107 ALA A 16 ALA~? 13.77 O2 GOL A1148 A 136 TYR A 15 TYR~? 21.33 O2 GOL A1148 A 140 LYS A 11 LYS~? 21.22 O2 GOL A1148 coo 55.90 7.49 23.83 56.71 8.23 22.76 20.73 5.63 36.55 19.90 5.46 37.82 coo 59.38 10.02 17.51 59.95 9.89 20.21 24.27 10.54 36.14 25.23 13.15 35.99 coo 59.52 3.69 18.67 62.31 6.19 22.58 21.22 13.78 38.77 26.11 13.41 41.35 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 2 3 # 2 A 107 ALA A 124 ALA~? 7.24 O3 SO4 A1146 A 136 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 140 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 55.90 7.49 23.83 56.71 8.23 22.76 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 59.38 10.02 17.51 59.95 9.89 20.21 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 59.52 3.69 18.67 62.31 6.19 22.58 -7.58 2.17 35.54 -5.66 0.99 29.63 1e7q_c01 source 1e7q GDP-FUCOSE SYNTHETASE : 2 hits 1e7q_c01 naa= 3 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 A 107 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 246 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 275 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 28.44 37.56 46.79 26.87 37.11 48.10 13.54 20.21 31.37 12.47 20.57 29.56 coo 22.84 50.35 52.24 23.24 48.32 52.90 21.37 14.29 44.78 22.74 12.93 43.92 coo 26.67 42.94 48.26 27.49 41.07 48.73 15.28 17.18 36.03 17.14 16.78 35.14 1ehy_c00 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 1 hits 1ehy_c00 naa= 3 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 B 107 ASP A 72 ASP.? 25.04 C1 GOL A1147 B 246 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 275 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 34.84 56.77 81.62 34.95 54.74 82.03 13.54 20.21 31.37 12.47 20.57 29.56 coo 43.18 49.30 68.39 44.75 49.87 69.78 21.37 14.29 44.78 22.74 12.93 43.92 coo 38.73 55.10 77.62 36.80 55.01 78.46 15.28 17.18 36.03 17.14 16.78 35.14 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 B 107 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 246 ASP A 72 ASP.? 25.04 C1 GOL A1147 B 275 HIS A 79 HIS~? 16.50 O3 SO4 A1146 coo 34.84 56.77 81.62 34.95 54.74 82.03 -0.83 10.88 33.15 0.71 12.12 33.87 coo 43.18 49.30 68.39 44.75 49.87 69.78 13.54 20.21 31.37 12.47 20.57 29.56 coo 38.73 55.10 77.62 36.80 55.01 78.46 4.14 13.68 32.87 3.48 14.92 34.43 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 72 ASP.? 25.04 C1 GOL A1147 C 246 ASP A 9 ASP.? 18.33 O2 GOL A1148 C 275 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 1.90 35.26 72.76 3.20 35.74 71.18 13.54 20.21 31.37 12.47 20.57 29.56 coo 12.03 20.33 71.56 10.48 19.25 70.56 21.37 14.29 44.78 22.74 12.93 43.92 coo 3.92 29.96 71.75 4.22 31.96 72.31 15.28 17.18 36.03 17.14 16.78 35.14 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 C 107 ASP A 121 ASP~? 13.01 O3 SO4 A1146 C 246 ASP A 72 ASP.? 25.04 C1 GOL A1147 C 275 HIS A 79 HIS~? 16.50 O3 SO4 A1146 coo 1.90 35.26 72.76 3.20 35.74 71.18 -0.83 10.88 33.15 0.71 12.12 33.87 coo 12.03 20.33 71.56 10.48 19.25 70.56 13.54 20.21 31.37 12.47 20.57 29.56 coo 3.92 29.96 71.75 4.22 31.96 72.31 4.14 13.68 32.87 3.48 14.92 34.43 1ehy_c02 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 2 hits 1ehy_c02 naa= 3 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 D 107 ASP A 72 ASP.? 25.04 C1 GOL A1147 D 246 ASP A 9 ASP.? 18.33 O2 GOL A1148 D 275 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 37.41 19.89 81.58 37.64 21.98 81.53 13.54 20.21 31.37 12.47 20.57 29.56 coo 23.50 26.43 88.52 24.76 26.47 90.29 21.37 14.29 44.78 22.74 12.93 43.92 coo 33.16 21.44 85.29 34.07 21.53 83.40 15.28 17.18 36.03 17.14 16.78 35.14 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 D 107 ASP A 121 ASP~? 13.01 O3 SO4 A1146 D 246 ASP A 72 ASP.? 25.04 C1 GOL A1147 D 275 HIS A 79 HIS~? 16.50 O3 SO4 A1146 coo 37.41 19.89 81.58 37.64 21.98 81.53 -0.83 10.88 33.15 0.71 12.12 33.87 coo 23.50 26.43 88.52 24.76 26.47 90.29 13.54 20.21 31.37 12.47 20.57 29.56 coo 33.16 21.44 85.29 34.07 21.53 83.40 4.14 13.68 32.87 3.48 14.92 34.43 1ehy_c03 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 2 hits 1ehy_c03 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 113 ALA~? 16.68 O3 SO4 A1146 A 257 ALA A 115 ALA~? 20.18 O2 GOL A1148 A 328 ASP A 117 ASP.? 22.23 O3 SO4 A1146 coo 39.84 24.12 8.44 38.50 24.23 9.11 -0.41 12.55 42.26 -1.47 11.46 42.34 coo 43.22 26.73 5.37 41.81 27.09 5.79 2.93 16.36 44.39 4.19 15.74 43.78 coo 38.17 34.10 6.67 37.72 32.06 6.84 -3.43 20.34 41.23 -3.74 20.53 43.32 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 1 hits 1eo7_c00 naa= 3 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 159 LYS A 33 LYS.? 8.85 O3 GOL A1148 A 193 GLU A 26 GLU~? -5.34 O3 BGOL A1147s A 217 VAL A 24 VAL~? 7.35 O1 GOL A1147 coo 2.10 10.68 61.44 -2.14 13.16 60.61 8.51 -4.81 32.23 11.26 -4.33 37.14 coo -5.33 11.71 69.72 -4.62 11.92 67.73 12.58 -0.11 23.07 11.74 0.33 21.17 coo 0.07 12.29 66.53 -0.24 11.95 64.38 12.42 0.96 29.54 12.57 2.15 31.36 1et0_c00 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 1 hits 1et0_c00 naa= 3 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 38 THR A 82 THR~? 12.65 O4 SO4 A1146 A 159 LYS A 128 LYS~? -2.87 O2 SO4 A1146s A 193 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo -2.58 16.31 54.79 -4.02 14.93 55.64 2.98 6.68 32.95 2.36 7.89 34.64 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -7.58 2.17 35.54 -5.66 0.99 29.63 coo -5.33 11.71 69.72 -4.62 11.92 67.73 -0.81 -7.81 39.86 -2.88 -7.29 39.80 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 38 THR A 82 THR~? 12.65 O4 SO4 A1146 A 159 LYS A 128 LYS~? -2.87 O2 SO4 A1146s A 193 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -2.58 16.31 54.79 -4.02 14.93 55.64 2.98 6.68 32.95 2.36 7.89 34.64 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -7.58 2.17 35.54 -5.66 0.99 29.63 coo -5.33 11.71 69.72 -4.62 11.92 67.73 -4.46 7.21 46.33 -4.54 9.09 47.28 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 3 3 # 3 A 38 THR A 110 THR~? 16.16 O2 GOL A1148 A 159 LYS A 104 LYS~? -2.54 O2 GOL A1148s A 193 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo -2.58 16.31 54.79 -4.02 14.93 55.64 0.29 8.02 44.77 -0.51 6.84 46.38 coo 2.10 10.68 61.44 -2.14 13.16 60.61 6.01 0.08 43.69 10.87 -1.21 45.63 coo -5.33 11.71 69.72 -4.62 11.92 67.73 -0.81 -7.81 39.86 -2.88 -7.29 39.80 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 3 hits 1et0_c02 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP A 6 ASP.? 21.81 O2 GOL A1148 260 GLU A 64 GLU~? 15.67 O2 GOL A1148 370 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 21.58 19.24 41.26 20.54 17.38 41.15 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 13.54 14.68 45.68 14.95 13.29 46.42 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 11.51 13.23 39.94 12.02 10.95 38.44 ULMN 3 1euu_c00 SIALIDASE user 2 3 # 2 92 ASP A 101 ASP~? 7.23 O3 GOL A1148 260 GLU A 94 GLU~? 15.24 O2 SO4 A1146 370 TYR A 129 TYR~? 7.58 O2 SO4 A1146 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 -3.64 -0.29 35.50 -3.07 -0.43 32.77 ULMN 3 1euu_c00 SIALIDASE user 3 3 # 3 92 ASP A 101 ASP~? 7.23 O3 GOL A1148 260 GLU A 94 GLU~? 15.24 O2 SO4 A1146 370 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 -3.37 0.40 41.39 -0.81 -0.40 40.59 1euu_c00 source 1euu SIALIDASE : 3 hits 1euu_c00 naa= 3 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 1 3 # 1 A 34 GLU A 26 GLU~? -5.34 O3 BGOL A1147s A 260 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 270 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 50.99 29.43 12.86 52.11 29.45 14.65 12.58 -0.11 23.07 11.74 0.33 21.17 coo 39.80 27.50 22.98 42.20 26.56 21.34 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 48.83 21.70 19.50 47.44 24.99 15.25 8.51 -4.81 32.23 11.26 -4.33 37.14 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 2 3 # 2 A 34 GLU A 64 GLU~? 15.67 O2 GOL A1148 A 260 ARG A 56 ARG~? 10.90 O2 GOL A1148 A 270 LYS A 11 LYS~? 21.22 O2 GOL A1148 coo 50.99 29.43 12.86 52.11 29.45 14.65 13.54 14.68 45.68 14.95 13.29 46.42 coo 39.80 27.50 22.98 42.20 26.56 21.34 22.32 4.42 45.18 23.04 1.62 46.30 coo 48.83 21.70 19.50 47.44 24.99 15.25 21.22 13.78 38.77 26.11 13.41 41.35 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 3 3 # 3 A 34 GLU A 64 GLU~? 15.67 O2 GOL A1148 A 260 ARG A 77 ARG~? 14.83 O1 GOL A1147 A 270 LYS A 11 LYS~? 21.22 O2 GOL A1148 coo 50.99 29.43 12.86 52.11 29.45 14.65 13.54 14.68 45.68 14.95 13.29 46.42 coo 39.80 27.50 22.98 42.20 26.56 21.34 13.84 10.22 30.84 16.69 9.80 29.81 coo 48.83 21.70 19.50 47.44 24.99 15.25 21.22 13.78 38.77 26.11 13.41 41.35 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 4 3 # 4 A 34 GLU A 94 GLU~? 15.24 O2 SO4 A1146 A 260 ARG A 137 ARG~? 7.86 O1 GOL A1148 A 270 LYS A 104 LYS~? -2.54 O2 GOL A1148s coo 50.99 29.43 12.86 52.11 29.45 14.65 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 39.80 27.50 22.98 42.20 26.56 21.34 3.45 0.43 53.78 6.50 0.05 53.66 coo 48.83 21.70 19.50 47.44 24.99 15.25 6.01 0.08 43.69 10.87 -1.21 45.63 1euy_c00 source 1euy GLUTAMINYL-TRNA SYNTHETASE : 4 hits 1euy_c00 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE A 42 PHE~? 13.86 O2 GOL A1148 A 210 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 244 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 9.23 46.77 25.11 11.48 48.39 24.76 7.20 3.94 37.34 6.03 3.85 34.80 coo 10.51 37.86 19.71 9.07 39.38 20.04 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -1.20 42.34 17.67 3.19 45.13 19.06 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 112 PHE A 42 PHE~? 13.86 O2 GOL A1148 A 210 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 244 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 9.23 46.77 25.11 11.48 48.39 24.76 7.20 3.94 37.34 6.03 3.85 34.80 coo 10.51 37.86 19.71 9.07 39.38 20.04 -0.83 10.88 33.15 0.71 12.12 33.87 coo -1.20 42.34 17.67 3.19 45.13 19.06 -7.58 2.17 35.54 -5.66 0.99 29.63 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE A 42 PHE~? 13.86 O2 GOL A1148 B 210 ASP A 102 ASP~? 12.37 O2 GOL A1148 B 244 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 8.76 47.85 34.91 11.08 46.36 35.41 7.20 3.94 37.34 6.03 3.85 34.80 coo 9.06 56.85 40.30 7.71 55.27 39.90 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -2.38 51.82 41.62 2.07 49.19 40.42 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 112 PHE A 42 PHE~? 13.86 O2 GOL A1148 B 210 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 244 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 8.76 47.85 34.91 11.08 46.36 35.41 7.20 3.94 37.34 6.03 3.85 34.80 coo 9.06 56.85 40.30 7.71 55.27 39.90 -0.83 10.88 33.15 0.71 12.12 33.87 coo -2.38 51.82 41.62 2.07 49.19 40.42 -7.58 2.17 35.54 -5.66 0.99 29.63 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c03 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 A 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 3.48 0.88 39.62 3.01 1.86 37.72 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR A 130 TYR~? 13.79 O2 SO4 A1146 A 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 A 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 -3.37 0.40 41.39 -0.81 -0.40 40.59 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 3.48 0.88 39.62 3.01 1.86 37.72 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 -7.58 2.17 35.54 -5.66 0.99 29.63 1fdy_c00 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c00 naa= 3 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 137 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 B 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 3.48 0.88 39.62 3.01 1.86 37.72 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR A 130 TYR~? 13.79 O2 SO4 A1146 B 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 B 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 -3.37 0.40 41.39 -0.81 -0.40 40.59 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 3.48 0.88 39.62 3.01 1.86 37.72 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 -7.58 2.17 35.54 -5.66 0.99 29.63 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 129 TYR~? 7.58 O2 SO4 A1146 C 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 C 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 3.48 0.88 39.62 3.01 1.86 37.72 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 137 TYR A 130 TYR~? 13.79 O2 SO4 A1146 C 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 C 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 -3.37 0.40 41.39 -0.81 -0.40 40.59 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 3.48 0.88 39.62 3.01 1.86 37.72 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 -7.58 2.17 35.54 -5.66 0.99 29.63 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 129 TYR~? 7.58 O2 SO4 A1146 D 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 D 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 3.48 0.88 39.62 3.01 1.86 37.72 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR A 130 TYR~? 13.79 O2 SO4 A1146 D 142 LEU A 105 LEU~? 13.11 O2 GOL A1148 D 165 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 -3.37 0.40 41.39 -0.81 -0.40 40.59 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 3.48 0.88 39.62 3.01 1.86 37.72 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 -7.58 2.17 35.54 -5.66 0.99 29.63 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c03 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 22 ARG~? 9.54 O3 BGOL A1147 A 136 GLU A 27 GLU~? -3.67 O1 GOL A1147s A 246 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 13.48 30.30 107.06 11.75 30.99 109.44 14.87 3.60 22.71 13.15 4.40 20.32 coo 9.46 32.37 115.82 8.50 34.20 115.47 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 11.99 34.33 109.92 10.08 34.19 110.77 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 29 ARG~? 10.10 O3 BGOL A1147 A 136 GLU A 27 GLU~? -3.67 O1 GOL A1147s A 246 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 13.48 30.30 107.06 11.75 30.99 109.44 7.64 2.56 22.30 9.21 4.89 21.02 coo 9.46 32.37 115.82 8.50 34.20 115.47 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 11.99 34.33 109.92 10.08 34.19 110.77 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG A 34 ARG.? 5.20 O3 AGOL A1147 A 136 GLU A 26 GLU~? -5.34 O3 BGOL A1147s A 246 GLU A 27 GLU~? -3.67 O1 GOL A1147s coo 13.48 30.30 107.06 11.75 30.99 109.44 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 9.46 32.37 115.82 8.50 34.20 115.47 12.58 -0.11 23.07 11.74 0.33 21.17 coo 11.99 34.33 109.92 10.08 34.19 110.77 11.27 -3.81 28.47 12.69 -3.93 29.99 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 136 GLU A 94 GLU~? 15.24 O2 SO4 A1146 A 246 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 13.48 30.30 107.06 11.75 30.99 109.44 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 9.46 32.37 115.82 8.50 34.20 115.47 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 11.99 34.33 109.92 10.08 34.19 110.77 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 4 hits 1fhl_c00 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 22 ARG~? 9.54 O3 BGOL A1147 A 136 GLU A 27 GLU~? -3.67 O1 GOL A1147s A 246 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 13.94 29.84 106.80 11.67 30.40 108.79 14.87 3.60 22.71 13.15 4.40 20.32 coo 9.52 31.97 115.23 8.45 33.74 114.72 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 11.92 33.82 109.35 10.10 33.50 110.39 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 29 ARG~? 10.10 O3 BGOL A1147 A 136 GLU A 27 GLU~? -3.67 O1 GOL A1147s A 246 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 13.94 29.84 106.80 11.67 30.40 108.79 7.64 2.56 22.30 9.21 4.89 21.02 coo 9.52 31.97 115.23 8.45 33.74 114.72 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 11.92 33.82 109.35 10.10 33.50 110.39 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG A 34 ARG.? 5.20 O3 AGOL A1147 A 136 GLU A 26 GLU~? -5.34 O3 BGOL A1147s A 246 GLU A 27 GLU~? -3.67 O1 GOL A1147s coo 13.94 29.84 106.80 11.67 30.40 108.79 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 9.52 31.97 115.23 8.45 33.74 114.72 12.58 -0.11 23.07 11.74 0.33 21.17 coo 11.92 33.82 109.35 10.10 33.50 110.39 11.27 -3.81 28.47 12.69 -3.93 29.99 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 136 GLU A 94 GLU~? 15.24 O2 SO4 A1146 A 246 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 13.94 29.84 106.80 11.67 30.40 108.79 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 9.52 31.97 115.23 8.45 33.74 114.72 -0.81 -7.81 39.86 -2.88 -7.29 39.80 coo 11.92 33.82 109.35 10.10 33.50 110.39 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 4 hits 1fob_c00 naa= 3 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 1 3 # 1 A 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 A 289 TYR A 15 TYR~? 21.33 O2 GOL A1148 coo 54.86 40.00 47.23 55.57 38.60 48.67 21.37 14.29 44.78 22.74 12.93 43.92 coo 52.08 40.18 50.14 50.83 38.93 47.73 19.79 9.88 44.03 17.28 11.31 45.11 coo 57.82 31.70 50.73 57.94 34.00 49.17 24.27 10.54 36.14 25.23 13.15 35.99 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 2 3 # 2 A 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 A 289 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 54.86 40.00 47.23 55.57 38.60 48.67 21.37 14.29 44.78 22.74 12.93 43.92 coo 52.08 40.18 50.14 50.83 38.93 47.73 19.79 9.88 44.03 17.28 11.31 45.11 coo 57.82 31.70 50.73 57.94 34.00 49.17 11.51 13.23 39.94 12.02 10.95 38.44 1foh_c00 source 1foh PHENOL HYDROXYLASE : 2 hits 1foh_c00 naa= 3 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 1 3 # 1 B 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 B 289 TYR A 15 TYR~? 21.33 O2 GOL A1148 coo 90.56 80.24 98.04 90.36 81.53 96.34 21.37 14.29 44.78 22.74 12.93 43.92 coo 86.62 80.67 97.51 87.37 82.00 100.10 19.79 9.88 44.03 17.28 11.31 45.11 coo 91.83 88.28 92.88 92.60 85.93 94.14 24.27 10.54 36.14 25.23 13.15 35.99 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 2 3 # 2 B 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 B 289 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 90.56 80.24 98.04 90.36 81.53 96.34 21.37 14.29 44.78 22.74 12.93 43.92 coo 86.62 80.67 97.51 87.37 82.00 100.10 19.79 9.88 44.03 17.28 11.31 45.11 coo 91.83 88.28 92.88 92.60 85.93 94.14 11.51 13.23 39.94 12.02 10.95 38.44 1foh_c01 source 1foh PHENOL HYDROXYLASE : 2 hits 1foh_c01 naa= 3 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 1 3 # 1 C 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 C 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 C 289 TYR A 15 TYR~? 21.33 O2 GOL A1148 coo 42.34 76.83 49.10 43.06 78.59 50.01 21.37 14.29 44.78 22.74 12.93 43.92 coo 46.12 77.15 48.13 44.44 77.61 45.70 19.79 9.88 44.03 17.28 11.31 45.11 coo 42.69 86.18 51.69 41.59 83.63 51.54 24.27 10.54 36.14 25.23 13.15 35.99 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 2 3 # 2 C 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 C 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 C 289 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 42.34 76.83 49.10 43.06 78.59 50.01 21.37 14.29 44.78 22.74 12.93 43.92 coo 46.12 77.15 48.13 44.44 77.61 45.70 19.79 9.88 44.03 17.28 11.31 45.11 coo 42.69 86.18 51.69 41.59 83.63 51.54 11.51 13.23 39.94 12.02 10.95 38.44 1foh_c02 source 1foh PHENOL HYDROXYLASE : 2 hits 1foh_c02 naa= 3 ULMN 3 1foh_c03 PHENOL HYDROXYLASE user 1 3 # 1 D 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 D 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 D 289 TYR A 15 TYR~? 21.33 O2 GOL A1148 coo 75.05 45.80 106.18 74.73 43.88 105.51 21.37 14.29 44.78 22.74 12.93 43.92 coo 78.52 44.93 104.78 78.72 44.49 107.76 19.79 9.88 44.03 17.28 11.31 45.11 coo 72.35 36.51 104.82 72.00 39.20 105.46 24.27 10.54 36.14 25.23 13.15 35.99 ULMN 3 1foh_c03 PHENOL HYDROXYLASE user 2 3 # 2 D 54 ASP A 9 ASP.? 18.33 O2 GOL A1148 D 281 ARG A 12 ARG~? 14.35 O2 GOL A1148 D 289 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 75.05 45.80 106.18 74.73 43.88 105.51 21.37 14.29 44.78 22.74 12.93 43.92 coo 78.52 44.93 104.78 78.72 44.49 107.76 19.79 9.88 44.03 17.28 11.31 45.11 coo 72.35 36.51 104.82 72.00 39.20 105.46 11.51 13.23 39.94 12.02 10.95 38.44 1foh_c03 source 1foh PHENOL HYDROXYLASE : 2 hits 1foh_c03 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU A 134 GLU.? 19.30 O3 SO4 A1146 B 319 ASP A 135 ASP~? 12.04 O1 GOL A1148 B 359 ARG A 137 ARG~? 7.86 O1 GOL A1148 coo 10.77 13.13 40.94 11.03 14.73 39.51 -4.46 7.21 46.33 -4.54 9.09 47.28 coo 3.77 12.64 38.21 3.35 14.53 37.39 0.67 3.61 47.99 2.00 2.44 49.10 coo -1.16 15.32 35.60 -3.32 13.56 36.98 3.45 0.43 53.78 6.50 0.05 53.66 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c01 naa= 3 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 1 3 # 1 A 314 TRP A 37 TRP~? 7.86 O1 GOL A1147 A 317 GLU A 27 GLU~? -3.67 O1 GOL A1147s A 365 ARG A 77 ARG~? 14.83 O1 GOL A1147 coo 79.91 26.87 38.77 78.95 23.18 37.81 14.43 -1.35 33.32 10.60 -0.46 33.68 coo 85.55 26.30 41.25 85.59 24.97 39.65 11.27 -3.81 28.47 12.69 -3.93 29.99 coo 83.47 25.30 27.10 83.44 27.82 25.29 13.84 10.22 30.84 16.69 9.80 29.81 1g8o_c01 source 1g8o N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALACTOSYLTRA: 1 hits 1g8o_c01 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 134 GLU.? 19.30 O3 SO4 A1146 A 47 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 161 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo 37.12 18.35 73.76 37.09 16.69 72.44 -4.46 7.21 46.33 -4.54 9.09 47.28 coo 29.81 8.06 73.13 30.21 10.11 72.95 -0.83 10.88 33.15 0.71 12.12 33.87 coo 37.29 15.56 67.90 37.37 13.79 70.08 -3.37 0.40 41.39 -0.81 -0.40 40.59 1geq_c02 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c02 naa= 3 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 B 36 GLU A 134 GLU.? 19.30 O3 SO4 A1146 B 47 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 161 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo 53.87 35.49 53.22 55.44 35.72 54.61 -4.46 7.21 46.33 -4.54 9.09 47.28 coo 63.47 43.65 53.95 61.45 43.07 54.06 -0.83 10.88 33.15 0.71 12.12 33.87 coo 56.38 35.81 59.19 58.25 35.77 57.10 -3.37 0.40 41.39 -0.81 -0.40 40.59 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c03 naa= 3 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 1 3 # 1 160 LYS A 104 LYS~? -2.54 O2 GOL A1148s 210 ARG A 12 ARG~? 14.35 O2 GOL A1148 225 ARG A 56 ARG~? 10.90 O2 GOL A1148 coo 17.51 28.50 73.42 17.24 23.02 75.86 6.01 0.08 43.69 10.87 -1.21 45.63 coo 24.74 11.56 73.05 25.29 14.32 71.80 19.79 9.88 44.03 17.28 11.31 45.11 coo 27.81 15.44 77.10 25.66 16.50 75.19 22.32 4.42 45.18 23.04 1.62 46.30 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS A 104 LYS~? -2.54 O2 GOL A1148s 210 ARG A 32 ARG.? 8.17 O3 AGOL A1147 225 ARG A 34 ARG.? 5.20 O3 AGOL A1147 coo 17.51 28.50 73.42 17.24 23.02 75.86 6.01 0.08 43.69 10.87 -1.21 45.63 coo 24.74 11.56 73.05 25.29 14.32 71.80 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 27.81 15.44 77.10 25.66 16.50 75.19 11.31 -8.21 28.23 9.62 -10.21 26.60 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 3 3 # 3 160 LYS A 104 LYS~? -2.54 O2 GOL A1148s 210 ARG A 32 ARG.? 8.17 O3 AGOL A1147 225 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 17.51 28.50 73.42 17.24 23.02 75.86 6.01 0.08 43.69 10.87 -1.21 45.63 coo 24.74 11.56 73.05 25.29 14.32 71.80 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 27.81 15.44 77.10 25.66 16.50 75.19 -0.38 -7.27 28.98 1.86 -8.15 27.08 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 4 3 # 4 160 LYS A 104 LYS~? -2.54 O2 GOL A1148s 210 ARG A 34 ARG.? 5.20 O3 AGOL A1147 225 ARG A 32 ARG.? 8.17 O3 AGOL A1147 coo 17.51 28.50 73.42 17.24 23.02 75.86 6.01 0.08 43.69 10.87 -1.21 45.63 coo 24.74 11.56 73.05 25.29 14.32 71.80 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 27.81 15.44 77.10 25.66 16.50 75.19 5.64 -9.61 30.19 6.78 -11.86 28.47 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 5 3 # 5 160 LYS A 104 LYS~? -2.54 O2 GOL A1148s 210 ARG A 56 ARG~? 10.90 O2 GOL A1148 225 ARG A 12 ARG~? 14.35 O2 GOL A1148 coo 17.51 28.50 73.42 17.24 23.02 75.86 6.01 0.08 43.69 10.87 -1.21 45.63 coo 24.74 11.56 73.05 25.29 14.32 71.80 22.32 4.42 45.18 23.04 1.62 46.30 coo 27.81 15.44 77.10 25.66 16.50 75.19 19.79 9.88 44.03 17.28 11.31 45.11 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 6 3 # 6 160 LYS A 104 LYS~? -2.54 O2 GOL A1148s 210 ARG A 91 ARG.? 9.03 O3 AGOL A1147 225 ARG A 32 ARG.? 8.17 O3 AGOL A1147 coo 17.51 28.50 73.42 17.24 23.02 75.86 6.01 0.08 43.69 10.87 -1.21 45.63 coo 24.74 11.56 73.05 25.29 14.32 71.80 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 27.81 15.44 77.10 25.66 16.50 75.19 5.64 -9.61 30.19 6.78 -11.86 28.47 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 6 hits 1gsa_c00 naa= 3 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 1 3 # 1 A1132 ASP A 117 ASP.? 22.23 O3 SO4 A1146 A1134 ALA A 113 ALA~? 16.68 O3 SO4 A1146 A1137 ASN A 119 ASN~? 16.25 O3 SO4 A1146 coo -27.05 34.58 17.12 -25.81 32.84 17.16 -3.43 20.34 41.23 -3.74 20.53 43.32 coo -20.53 36.39 15.81 -20.80 35.01 16.40 -0.41 12.55 42.26 -1.47 11.46 42.34 coo -23.72 34.69 12.49 -24.32 32.83 13.34 -1.94 14.59 39.42 -3.88 15.03 40.22 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 2 3 # 2 A1132 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A1134 ALA A 118 ALA.? 18.69 O3 SO4 A1146 A1137 ASN A 119 ASN~? 16.25 O3 SO4 A1146 coo -27.05 34.58 17.12 -25.81 32.84 17.16 -0.83 10.88 33.15 0.71 12.12 33.87 coo -20.53 36.39 15.81 -20.80 35.01 16.40 -1.61 18.57 37.21 -0.61 19.44 36.46 coo -23.72 34.69 12.49 -24.32 32.83 13.34 -1.94 14.59 39.42 -3.88 15.03 40.22 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 3 3 # 3 A1132 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A1134 ALA A 124 ALA~? 7.24 O3 SO4 A1146 A1137 ASN A 86 ASN~? -7.27 O3 SO4 A1146s coo -27.05 34.58 17.12 -25.81 32.84 17.16 -0.83 10.88 33.15 0.71 12.12 33.87 coo -20.53 36.39 15.81 -20.80 35.01 16.40 -5.77 7.91 35.54 -5.54 8.44 34.13 coo -23.72 34.69 12.49 -24.32 32.83 13.34 -2.38 5.31 30.77 -2.40 5.93 32.80 1ir3_c02 source 1ir3 INSULIN RECEPTOR : 3 hits 1ir3_c02 naa= 3 ULMN 3 1jdw_c01 L-ARGININE-GLYCINE AMIDINOTRANSFERASuser 1 3 # 1 254 ASP A 121 ASP~? 13.01 O3 SO4 A1146 303 HIS A 79 HIS~? 16.50 O3 SO4 A1146 407 CYH A 81 CYH~? 12.40 C1 GOL A1147 coo 49.08 66.55 9.14 50.71 67.89 8.88 -0.83 10.88 33.15 0.71 12.12 33.87 coo 47.11 68.57 13.19 49.07 68.74 12.45 4.14 13.68 32.87 3.48 14.92 34.43 coo 49.32 64.84 19.61 47.95 67.13 18.88 6.31 6.18 31.19 9.06 5.87 31.56 1jdw_c01 source 1jdw L-ARGININE-GLYCINE AMIDINOTRANSFERASE : 1 hits 1jdw_c01 naa= 3 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 # 1 A 55 ASP A 6 ASP.? 21.81 O2 GOL A1148 A 58 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 424 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 58.42 47.76 20.67 58.01 49.10 19.12 21.58 19.24 41.26 20.54 17.38 41.15 coo 58.59 41.80 18.81 58.94 43.89 18.94 21.37 14.29 44.78 22.74 12.93 43.92 coo 52.85 46.34 13.34 54.09 44.97 14.42 13.54 14.68 45.68 14.95 13.29 46.42 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 2 3 # 2 A 55 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 58 ASP A 6 ASP.? 21.81 O2 GOL A1148 A 424 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 58.42 47.76 20.67 58.01 49.10 19.12 21.37 14.29 44.78 22.74 12.93 43.92 coo 58.59 41.80 18.81 58.94 43.89 18.94 21.58 19.24 41.26 20.54 17.38 41.15 coo 52.85 46.34 13.34 54.09 44.97 14.42 13.54 14.68 45.68 14.95 13.29 46.42 1js4_c00 source 1js4 ENDO-EXOCELLULASE E4 : 2 hits 1js4_c00 naa= 3 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 # 1 B 55 ASP A 6 ASP.? 21.81 O2 GOL A1148 B 58 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 424 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 112.10 61.46 19.99 111.82 60.65 18.07 21.58 19.24 41.26 20.54 17.38 41.15 coo 117.85 63.62 21.08 115.96 63.25 20.18 21.37 14.29 44.78 22.74 12.93 43.92 coo 118.47 57.23 15.57 119.32 58.77 16.73 13.54 14.68 45.68 14.95 13.29 46.42 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 # 2 B 55 ASP A 9 ASP.? 18.33 O2 GOL A1148 B 58 ASP A 6 ASP.? 21.81 O2 GOL A1148 B 424 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 112.10 61.46 19.99 111.82 60.65 18.07 21.37 14.29 44.78 22.74 12.93 43.92 coo 117.85 63.62 21.08 115.96 63.25 20.18 21.58 19.24 41.26 20.54 17.38 41.15 coo 118.47 57.23 15.57 119.32 58.77 16.73 13.54 14.68 45.68 14.95 13.29 46.42 1js4_c01 source 1js4 ENDO-EXOCELLULASE E4 : 2 hits 1js4_c01 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 64 GLU~? 15.67 O2 GOL A1148 B 56 LYS A 11 LYS~? 21.22 O2 GOL A1148 B 258 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 13.54 14.68 45.68 14.95 13.29 46.42 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 21.22 13.78 38.77 26.11 13.41 41.35 coo 2.64 1.83 34.81 1.56 1.13 32.02 15.67 8.12 51.97 17.20 9.77 49.88 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 1 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 64 GLU~? 15.67 O2 GOL A1148 C 56 LYS A 11 LYS~? 21.22 O2 GOL A1148 C 258 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 13.54 14.68 45.68 14.95 13.29 46.42 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 21.22 13.78 38.77 26.11 13.41 41.35 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 15.67 8.12 51.97 17.20 9.77 49.88 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 1 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 64 GLU~? 15.67 O2 GOL A1148 D 56 LYS A 11 LYS~? 21.22 O2 GOL A1148 D 258 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 13.54 14.68 45.68 14.95 13.29 46.42 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 21.22 13.78 38.77 26.11 13.41 41.35 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 15.67 8.12 51.97 17.20 9.77 49.88 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 1 hits 1k82_c03 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 26 GLU~? -5.34 O3 BGOL A1147s A 163 ARG A 22 ARG~? 9.54 O3 BGOL A1147 A 222 ARG A 29 ARG~? 10.10 O3 BGOL A1147 coo 51.27 81.34 48.31 51.67 80.79 50.28 12.58 -0.11 23.07 11.74 0.33 21.17 coo 48.06 78.22 50.94 48.51 78.27 53.98 14.87 3.60 22.71 13.15 4.40 20.32 coo 54.85 84.16 52.60 54.26 81.23 53.34 7.64 2.56 22.30 9.21 4.89 21.02 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU A 26 GLU~? -5.34 O3 BGOL A1147s A 163 ARG A 29 ARG~? 10.10 O3 BGOL A1147 A 222 ARG A 22 ARG~? 9.54 O3 BGOL A1147 coo 51.27 81.34 48.31 51.67 80.79 50.28 12.58 -0.11 23.07 11.74 0.33 21.17 coo 48.06 78.22 50.94 48.51 78.27 53.98 7.64 2.56 22.30 9.21 4.89 21.02 coo 54.85 84.16 52.60 54.26 81.23 53.34 14.87 3.60 22.71 13.15 4.40 20.32 1kim_c00 source 1kim THYMIDINE KINASE : 2 hits 1kim_c00 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 102 ASP~? 12.37 O2 GOL A1148 262 LYS A 104 LYS~? -2.54 O2 GOL A1148s 336 ARG A 32 ARG.? 8.17 O3 AGOL A1147 coo 61.88 50.78 12.96 63.84 50.60 13.71 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 63.59 44.40 18.32 63.20 49.74 17.95 6.01 0.08 43.69 10.87 -1.21 45.63 coo 72.60 57.42 15.86 71.61 56.68 18.70 5.64 -9.61 30.19 6.78 -11.86 28.47 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP A 102 ASP~? 12.37 O2 GOL A1148 262 LYS A 104 LYS~? -2.54 O2 GOL A1148s 336 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 61.88 50.78 12.96 63.84 50.60 13.71 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 63.59 44.40 18.32 63.20 49.74 17.95 6.01 0.08 43.69 10.87 -1.21 45.63 coo 72.60 57.42 15.86 71.61 56.68 18.70 -0.38 -7.27 28.98 1.86 -8.15 27.08 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 2 hits 1lam_c00 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 135 ASP~? 12.04 O1 GOL A1148 A 279 GLU A 63 GLU~? 22.88 O2 GOL A1148 A 369 ASP A 102 ASP~? 12.37 O2 GOL A1148 coo 11.74 38.14 80.19 10.63 36.40 80.65 0.67 3.61 47.99 2.00 2.44 49.10 coo 16.54 46.37 63.94 14.77 45.79 62.95 9.23 20.68 49.62 8.18 19.72 51.22 coo 12.19 31.08 87.29 11.13 32.66 86.38 1.78 -4.59 40.98 1.81 -5.91 42.65 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 1 hits 1m53_c06 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 29 ARG~? 10.10 O3 BGOL A1147 229 SER A 23 SER~? -4.55 O1 GOL A1147s 325 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 2.54 15.84 18.57 3.24 17.85 16.30 7.64 2.56 22.30 9.21 4.89 21.02 coo 10.17 13.48 15.92 9.61 15.76 15.27 14.87 -0.45 26.98 16.23 -1.01 28.95 coo 5.42 13.04 19.75 5.74 13.81 17.79 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 2 3 # 2 159 ARG A 34 ARG.? 5.20 O3 AGOL A1147 229 SER A 23 SER~? -4.55 O1 GOL A1147s 325 GLU A 27 GLU~? -3.67 O1 GOL A1147s coo 2.54 15.84 18.57 3.24 17.85 16.30 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 10.17 13.48 15.92 9.61 15.76 15.27 14.87 -0.45 26.98 16.23 -1.01 28.95 coo 5.42 13.04 19.75 5.74 13.81 17.79 11.27 -3.81 28.47 12.69 -3.93 29.99 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 3 3 # 3 159 ARG A 91 ARG.? 9.03 O3 AGOL A1147 229 SER A 92 SER~? 13.14 O2 SO4 A1146 325 GLU A 95 GLU~? 13.83 O2 SO4 A1146 coo 2.54 15.84 18.57 3.24 17.85 16.30 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 10.17 13.48 15.92 9.61 15.76 15.27 -4.00 -6.25 34.54 -3.33 -8.31 35.64 coo 5.42 13.04 19.75 5.74 13.81 17.79 -1.34 -10.20 33.52 -3.07 -10.54 32.36 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 3 hits 1mbb_c00 naa= 3 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 1 3 # 1 A 50 ASP A 135 ASP~? 12.04 O1 GOL A1148 A 55 TYR A 130 TYR~? 13.79 O2 SO4 A1146 A 84 LYS A 104 LYS~? -2.54 O2 GOL A1148s coo 11.09 42.89 24.44 11.32 42.06 22.49 0.67 3.61 47.99 2.00 2.44 49.10 coo 4.60 40.33 20.42 7.25 39.50 20.05 -3.37 0.40 41.39 -0.81 -0.40 40.59 coo 9.71 44.83 15.47 10.13 41.43 19.93 6.01 0.08 43.69 10.87 -1.21 45.63 1mrq_c02 source 1mrq ALDO-KETO REDUCTASE FAMILY 1 MEMBER C1 : 1 hits 1mrq_c02 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 197 ASP A 6 ASP.? 21.81 O2 GOL A1148 A 223 ALA A 16 ALA~? 13.77 O2 GOL A1148 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 15.28 17.18 36.03 17.14 16.78 35.14 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 21.58 19.24 41.26 20.54 17.38 41.15 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 20.73 5.63 36.55 19.90 5.46 37.82 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 A 114 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 197 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 223 ALA A 65 ALA~? 17.39 O2 GOL A1148 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 4.14 13.68 32.87 3.48 14.92 34.43 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 -0.83 10.88 33.15 0.71 12.12 33.87 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 8.93 14.91 44.13 7.68 14.23 44.71 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 A 114 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 197 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 223 ALA A 115 ALA~? 20.18 O2 GOL A1148 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 4.14 13.68 32.87 3.48 14.92 34.43 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 -0.83 10.88 33.15 0.71 12.12 33.87 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 2.93 16.36 44.39 4.19 15.74 43.78 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 3 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 71 HIS~? 22.50 O2 GOL A1148 B 197 ASP A 6 ASP.? 21.81 O2 GOL A1148 B 223 ALA A 16 ALA~? 13.77 O2 GOL A1148 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 15.28 17.18 36.03 17.14 16.78 35.14 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 21.58 19.24 41.26 20.54 17.38 41.15 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 20.73 5.63 36.55 19.90 5.46 37.82 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 B 114 HIS A 79 HIS~? 16.50 O3 SO4 A1146 B 197 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 223 ALA A 65 ALA~? 17.39 O2 GOL A1148 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 4.14 13.68 32.87 3.48 14.92 34.43 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 -0.83 10.88 33.15 0.71 12.12 33.87 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 8.93 14.91 44.13 7.68 14.23 44.71 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 B 114 HIS A 79 HIS~? 16.50 O3 SO4 A1146 B 197 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 223 ALA A 115 ALA~? 20.18 O2 GOL A1148 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 4.14 13.68 32.87 3.48 14.92 34.43 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 -0.83 10.88 33.15 0.71 12.12 33.87 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 2.93 16.36 44.39 4.19 15.74 43.78 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 3 hits 1n2t_c03 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 60 SER.? 16.93 O2 GOL A1148 A 154 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 261 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo 16.10 74.10 3.11 17.18 73.52 5.20 13.07 12.22 50.34 14.07 14.38 49.84 coo 16.07 84.71 8.14 15.20 82.81 8.14 21.37 14.29 44.78 22.74 12.93 43.92 coo 10.59 77.85 4.81 13.09 76.36 5.76 15.67 8.12 51.97 17.20 9.77 49.88 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 2 3 # 2 A 62 SER A 61 SER~? 19.05 O2 GOL A1148 A 154 ASP A 9 ASP.? 18.33 O2 GOL A1148 A 261 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo 16.10 74.10 3.11 17.18 73.52 5.20 9.98 14.43 50.52 11.23 16.46 50.08 coo 16.07 84.71 8.14 15.20 82.81 8.14 21.37 14.29 44.78 22.74 12.93 43.92 coo 10.59 77.85 4.81 13.09 76.36 5.76 15.67 8.12 51.97 17.20 9.77 49.88 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 2 hits 1o98_c00 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 65 ALA~? 17.39 O2 GOL A1148 A 126 LEU A 62 LEU~? 20.40 O2 GOL A1148 A 158 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo -2.29 37.66 144.73 -1.46 37.12 145.87 8.93 14.91 44.13 7.68 14.23 44.71 coo -4.62 32.83 147.14 -5.50 32.85 149.12 5.72 16.45 49.15 3.81 16.35 48.07 coo -0.83 29.57 149.77 -0.39 31.47 148.95 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 115 ALA~? 20.18 O2 GOL A1148 A 126 LEU A 62 LEU~? 20.40 O2 GOL A1148 A 158 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo -2.29 37.66 144.73 -1.46 37.12 145.87 2.93 16.36 44.39 4.19 15.74 43.78 coo -4.62 32.83 147.14 -5.50 32.85 149.12 5.72 16.45 49.15 3.81 16.35 48.07 coo -0.83 29.57 149.77 -0.39 31.47 148.95 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA A 124 ALA~? 7.24 O3 SO4 A1146 A 126 LEU A 126 LEU~? 13.42 O3 SO4 A1146 A 158 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -5.77 7.91 35.54 -5.54 8.44 34.13 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -4.50 5.51 40.83 -2.73 5.70 42.15 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -4.46 7.21 46.33 -4.54 9.09 47.28 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA A 127 ALA~? 8.84 O3 SO4 A1146 A 126 LEU A 126 LEU~? 13.42 O3 SO4 A1146 A 158 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -8.20 4.65 38.36 -8.85 5.85 37.67 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -4.50 5.51 40.83 -2.73 5.70 42.15 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -4.46 7.21 46.33 -4.54 9.09 47.28 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 65 ALA~? 17.39 O2 GOL A1148 B 126 LEU A 62 LEU~? 20.40 O2 GOL A1148 B 158 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo -39.79 4.61 147.27 -39.61 5.56 148.47 8.93 14.91 44.13 7.68 14.23 44.71 coo -34.22 5.06 149.25 -33.65 4.24 151.15 5.72 16.45 49.15 3.81 16.35 48.07 coo -33.03 9.93 151.71 -34.98 9.38 151.11 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 115 ALA~? 20.18 O2 GOL A1148 B 126 LEU A 62 LEU~? 20.40 O2 GOL A1148 B 158 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo -39.79 4.61 147.27 -39.61 5.56 148.47 2.93 16.36 44.39 4.19 15.74 43.78 coo -34.22 5.06 149.25 -33.65 4.24 151.15 5.72 16.45 49.15 3.81 16.35 48.07 coo -33.03 9.93 151.71 -34.98 9.38 151.11 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA A 124 ALA~? 7.24 O3 SO4 A1146 B 126 LEU A 126 LEU~? 13.42 O3 SO4 A1146 B 158 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -5.77 7.91 35.54 -5.54 8.44 34.13 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -4.50 5.51 40.83 -2.73 5.70 42.15 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -4.46 7.21 46.33 -4.54 9.09 47.28 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 B 70 ALA A 127 ALA~? 8.84 O3 SO4 A1146 B 126 LEU A 126 LEU~? 13.42 O3 SO4 A1146 B 158 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -8.20 4.65 38.36 -8.85 5.85 37.67 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -4.50 5.51 40.83 -2.73 5.70 42.15 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -4.46 7.21 46.33 -4.54 9.09 47.28 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 65 ALA~? 17.39 O2 GOL A1148 C 126 LEU A 62 LEU~? 20.40 O2 GOL A1148 C 158 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 8.93 14.91 44.13 7.68 14.23 44.71 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 5.72 16.45 49.15 3.81 16.35 48.07 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 115 ALA~? 20.18 O2 GOL A1148 C 126 LEU A 62 LEU~? 20.40 O2 GOL A1148 C 158 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 2.93 16.36 44.39 4.19 15.74 43.78 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 5.72 16.45 49.15 3.81 16.35 48.07 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 9.23 20.68 49.62 8.18 19.72 51.22 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA A 124 ALA~? 7.24 O3 SO4 A1146 C 126 LEU A 126 LEU~? 13.42 O3 SO4 A1146 C 158 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -4.50 5.51 40.83 -2.73 5.70 42.15 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -4.46 7.21 46.33 -4.54 9.09 47.28 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA A 127 ALA~? 8.84 O3 SO4 A1146 C 126 LEU A 126 LEU~? 13.42 O3 SO4 A1146 C 158 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -8.20 4.65 38.36 -8.85 5.85 37.67 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -4.50 5.51 40.83 -2.73 5.70 42.15 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -4.46 7.21 46.33 -4.54 9.09 47.28 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c02 naa= 3 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 1 3 # 1 B 248 ASP A 101 ASP~? 7.23 O3 GOL A1148 B 270 LYS A 33 LYS.? 8.85 O3 GOL A1148 B 382 MET A 109 MET~? 13.75 O3 SO4 A1146 coo -11.82 154.51 43.38 -12.86 152.74 43.79 7.29 -4.04 39.78 9.37 -4.30 39.92 coo -5.09 158.39 43.41 -0.74 158.80 47.15 8.51 -4.81 32.23 11.26 -4.33 37.14 coo -2.79 145.52 50.38 -5.75 148.14 51.66 1.66 7.22 41.29 1.71 6.79 38.02 1pjq_c03 source 1pjq SIROHEME SYNTHASE : 1 hits 1pjq_c03 naa= 3 ULMN 3 1pyl_c01 RIBONUCLEASE user 1 3 # 1 B 56 GLU A 80 GLU~? 13.34 C1 GOL A1147 B 67 ARG A 77 ARG~? 14.83 O1 GOL A1147 B 86 HIS A 79 HIS~? 16.50 O3 SO4 A1146 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 7.67 8.26 27.56 9.41 8.53 26.40 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 13.84 10.22 30.84 16.69 9.80 29.81 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 4.14 13.68 32.87 3.48 14.92 34.43 1pyl_c01 source 1pyl RIBONUCLEASE : 1 hits 1pyl_c01 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 105 LEU~? 13.11 O2 GOL A1148 A 58 ASP A 101 ASP~? 7.23 O3 GOL A1148 A 120 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 34.02 69.29 75.26 34.82 67.82 76.74 3.48 0.88 39.62 3.01 1.86 37.72 coo 34.46 72.45 78.57 32.82 72.75 77.28 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 28.96 77.64 81.19 29.05 74.53 77.51 8.51 -4.81 32.23 11.26 -4.33 37.14 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 1 hits 1pym_c00 naa= 3 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 B 48 LEU A 105 LEU~? 13.11 O2 GOL A1148 B 58 ASP A 101 ASP~? 7.23 O3 GOL A1148 B 120 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 54.50 104.32 58.69 55.83 105.69 59.81 3.48 0.88 39.62 3.01 1.86 37.72 coo 57.63 101.19 59.83 56.60 100.89 57.99 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 61.58 95.88 55.22 58.18 99.30 54.71 8.51 -4.81 32.23 11.26 -4.33 37.14 1pym_c01 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 1 hits 1pym_c01 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 68 ALA A 124 ALA~? 7.24 O3 SO4 A1146 A 72 LEU A 125 LEU~? 10.26 O3 SO4 A1146 coo 46.76 7.59 18.65 45.27 6.01 18.52 -0.83 10.88 33.15 0.71 12.12 33.87 coo 48.88 4.35 16.59 48.73 5.09 15.20 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 53.89 6.25 15.09 52.88 7.92 14.14 -1.78 5.14 36.16 -0.28 3.55 36.22 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 68 ALA A 124 ALA~? 7.24 O3 SO4 A1146 A 72 LEU A 126 LEU~? 13.42 O3 SO4 A1146 coo 46.76 7.59 18.65 45.27 6.01 18.52 -0.83 10.88 33.15 0.71 12.12 33.87 coo 48.88 4.35 16.59 48.73 5.09 15.20 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 53.89 6.25 15.09 52.88 7.92 14.14 -4.50 5.51 40.83 -2.73 5.70 42.15 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 2 hits 1q6l_c05 naa= 3 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG A 12 ARG~? 14.35 O2 GOL A1148 A 581 ARG A 56 ARG~? 10.90 O2 GOL A1148 A 713 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 19.79 9.88 44.03 17.28 11.31 45.11 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 22.32 4.42 45.18 23.04 1.62 46.30 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 15.67 8.12 51.97 17.20 9.77 49.88 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG A 56 ARG~? 10.90 O2 GOL A1148 A 581 ARG A 12 ARG~? 14.35 O2 GOL A1148 A 713 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 22.32 4.42 45.18 23.04 1.62 46.30 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 19.79 9.88 44.03 17.28 11.31 45.11 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 15.67 8.12 51.97 17.20 9.77 49.88 1qb4_c01 source 1qb4 PHOSPHOENOLPYRUVATE CARBOXYLASE : 2 hits 1qb4_c01 naa= 3 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 55.48 26.51 40.65 55.39 23.99 39.43 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 48.87 29.19 44.63 49.10 27.34 43.63 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 47.58 17.35 41.83 51.40 20.85 40.83 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c08 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c08 naa= 3 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 B 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c09 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c09 naa= 3 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 C 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 C 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 39.51 34.34 13.63 37.63 32.61 14.79 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 45.78 31.11 9.51 44.25 30.06 10.53 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 37.54 22.37 12.10 37.83 27.55 13.24 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c10 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c10 naa= 3 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 D 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 D 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c11 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c11 naa= 3 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 E 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 E 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c12 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c12 naa= 3 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 F 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 F 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c13 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c13 naa= 3 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 G 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 G 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c14 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c14 naa= 3 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 H 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 H 261 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 8.51 -4.81 32.23 11.26 -4.33 37.14 1qgn_c15 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c15 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 C 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 C 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 coo 39.01 29.77 22.02 37.48 31.30 19.84 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 39.51 34.34 13.63 37.63 32.61 14.79 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 45.78 31.11 9.51 44.25 30.06 10.53 1.78 -4.59 40.98 1.81 -5.91 42.65 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 D 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 D 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 1.78 -4.59 40.98 1.81 -5.91 42.65 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 C 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 55.48 26.51 40.65 55.39 23.99 39.43 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 48.87 29.19 44.63 49.10 27.34 43.63 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 52.39 23.42 32.10 54.51 23.27 34.29 -0.38 -7.27 28.98 1.86 -8.15 27.08 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 D 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -0.38 -7.27 28.98 1.86 -8.15 27.08 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 G 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 G 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 1.78 -4.59 40.98 1.81 -5.91 42.65 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 H 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 H 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 1.78 -4.59 40.98 1.81 -5.91 42.65 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 E 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 G 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -0.38 -7.27 28.98 1.86 -8.15 27.08 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 129 TYR~? 7.58 O2 SO4 A1146 F 236 ASP A 102 ASP~? 12.37 O2 GOL A1148 H 110 ARG A 91 ARG.? 9.03 O3 AGOL A1147 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 -0.38 -7.27 28.98 1.86 -8.15 27.08 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c23 naa= 3 ULMN 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 A 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 A 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo 1.42 19.18 21.84 1.11 19.57 23.28 11.54 19.14 41.93 12.74 19.20 42.85 coo 0.71 19.67 27.92 2.43 19.16 26.83 15.28 17.18 36.03 17.14 16.78 35.14 coo 7.15 16.22 27.50 6.15 18.00 27.94 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c00 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c00 naa= 3 ULMN 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 B 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 B 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 B 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo -33.97 19.78 54.18 -33.40 20.11 52.82 11.54 19.14 41.93 12.74 19.20 42.85 coo -33.17 20.01 48.16 -34.95 19.37 49.06 15.28 17.18 36.03 17.14 16.78 35.14 coo -39.82 16.62 48.85 -38.59 18.24 48.48 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c01 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c01 naa= 3 ULMN 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 C 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 C 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 C 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo -26.36 -19.12 21.15 -25.71 -19.49 22.47 11.54 19.14 41.93 12.74 19.20 42.85 coo -25.01 -20.21 26.78 -26.91 -20.55 25.93 15.28 17.18 36.03 17.14 16.78 35.14 coo -32.17 -20.34 27.36 -30.15 -20.93 27.54 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c02 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c02 naa= 3 ULMN 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 D 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 D 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 D 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo -6.15 -19.18 55.49 -6.70 -19.60 54.15 11.54 19.14 41.93 12.74 19.20 42.85 coo -7.62 -20.32 49.70 -5.89 -20.86 50.74 15.28 17.18 36.03 17.14 16.78 35.14 coo -0.41 -20.05 49.27 -2.21 -21.16 49.24 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c03 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c03 naa= 3 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 E 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 E 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 E 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 11.54 19.14 41.93 12.74 19.20 42.85 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 15.28 17.18 36.03 17.14 16.78 35.14 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c04 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c04 naa= 3 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 F 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 F 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 F 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo 5.33 15.59 -14.28 5.80 15.15 -15.64 11.54 19.14 41.93 12.74 19.20 42.85 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 15.28 17.18 36.03 17.14 16.78 35.14 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c05 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c05 naa= 3 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 G 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 G 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 G 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 11.54 19.14 41.93 12.74 19.20 42.85 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 15.28 17.18 36.03 17.14 16.78 35.14 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c06 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c06 naa= 3 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 H 51 ALA A 67 ALA~? 21.79 O2 GOL A1148 H 148 HIS A 71 HIS~? 22.50 O2 GOL A1148 H 163 ASP A 6 ASP.? 21.81 O2 GOL A1148 coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 11.54 19.14 41.93 12.74 19.20 42.85 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 15.28 17.18 36.03 17.14 16.78 35.14 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 21.58 19.24 41.26 20.54 17.38 41.15 1qol_c07 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c07 naa= 3 ULMN 3 1qrz_c20 PLASMINOGEN user 1 3 # 1 A 603 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 646 ASP A 6 ASP.? 21.81 O2 GOL A1148 A 739 GLY A 58 GLY.? 9.16 O2 GOL A1148 coo -20.72 2.99 34.37 -21.94 1.82 35.61 15.28 17.18 36.03 17.14 16.78 35.14 coo -18.83 7.68 26.86 -20.89 7.78 26.56 21.58 19.24 41.26 20.54 17.38 41.15 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 13.89 6.85 47.31 14.44 7.38 46.94 1qrz_c20 source 1qrz PLASMINOGEN : 1 hits 1qrz_c20 naa= 3 ULMN 3 1qrz_c21 PLASMINOGEN user 1 3 # 1 B 603 HIS A 71 HIS~? 22.50 O2 GOL A1148 B 646 ASP A 6 ASP.? 21.81 O2 GOL A1148 B 739 GLY A 58 GLY.? 9.16 O2 GOL A1148 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 15.28 17.18 36.03 17.14 16.78 35.14 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 21.58 19.24 41.26 20.54 17.38 41.15 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 13.89 6.85 47.31 14.44 7.38 46.94 1qrz_c21 source 1qrz PLASMINOGEN : 1 hits 1qrz_c21 naa= 3 ULMN 3 1qrz_c22 PLASMINOGEN user 1 3 # 1 C 603 HIS A 71 HIS~? 22.50 O2 GOL A1148 C 646 ASP A 6 ASP.? 21.81 O2 GOL A1148 C 739 GLY A 58 GLY.? 9.16 O2 GOL A1148 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 15.28 17.18 36.03 17.14 16.78 35.14 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 21.58 19.24 41.26 20.54 17.38 41.15 coo 7.82 1.25 3.03 7.30 1.31 3.65 13.89 6.85 47.31 14.44 7.38 46.94 1qrz_c22 source 1qrz PLASMINOGEN : 1 hits 1qrz_c22 naa= 3 ULMN 3 1qx3_c00 APOPAIN user 1 3 # 1 A 121 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 122 GLY A 83 GLY~? 9.44 O4 SO4 A1146 A 163 CYH A 81 CYH~? 12.40 C1 GOL A1147 coo 2.23 29.11 15.20 1.24 27.27 15.13 4.14 13.68 32.87 3.48 14.92 34.43 coo 2.54 34.86 14.60 1.83 34.53 14.82 1.28 7.34 29.60 1.75 6.71 29.80 coo -1.20 35.13 11.95 -2.11 32.67 12.98 6.31 6.18 31.19 9.06 5.87 31.56 1qx3_c00 source 1qx3 APOPAIN : 1 hits 1qx3_c00 naa= 3 ULMN 3 1qz9_c02 KYNURENINASE user 1 3 # 1 A 129 PHE A 97 PHE~? 12.37 O3 AGOL A1147 A 201 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 227 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 23.39 49.81 32.16 21.33 51.68 32.26 4.68 -2.71 36.32 5.13 -0.43 34.81 coo 25.52 45.12 37.98 23.98 46.65 37.85 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 12.68 46.83 36.69 18.26 48.67 34.51 -7.58 2.17 35.54 -5.66 0.99 29.63 1qz9_c02 source 1qz9 KYNURENINASE : 1 hits 1qz9_c02 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 117 ASP.? 22.23 O3 SO4 A1146 A 186 ASN A 119 ASN~? 16.25 O3 SO4 A1146 A 260 ALA A 65 ALA~? 17.39 O2 GOL A1148 coo 11.81 33.10 11.71 13.07 31.45 11.40 -3.43 20.34 41.23 -3.74 20.53 43.32 coo 11.43 26.53 7.41 13.01 27.56 8.43 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 21.53 26.33 6.96 20.26 25.69 7.52 8.93 14.91 44.13 7.68 14.23 44.71 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 # 2 A 10 ASP A 117 ASP.? 22.23 O3 SO4 A1146 A 186 ASN A 119 ASN~? 16.25 O3 SO4 A1146 A 260 ALA A 124 ALA~? 7.24 O3 SO4 A1146 coo 11.81 33.10 11.71 13.07 31.45 11.40 -3.43 20.34 41.23 -3.74 20.53 43.32 coo 11.43 26.53 7.41 13.01 27.56 8.43 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 21.53 26.33 6.96 20.26 25.69 7.52 -5.77 7.91 35.54 -5.54 8.44 34.13 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 3 3 # 3 A 10 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 186 ASN A 86 ASN~? -7.27 O3 SO4 A1146s A 260 ALA A 127 ALA~? 8.84 O3 SO4 A1146 coo 11.81 33.10 11.71 13.07 31.45 11.40 -0.83 10.88 33.15 0.71 12.12 33.87 coo 11.43 26.53 7.41 13.01 27.56 8.43 -2.38 5.31 30.77 -2.40 5.93 32.80 coo 21.53 26.33 6.96 20.26 25.69 7.52 -8.20 4.65 38.36 -8.85 5.85 37.67 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 4 3 # 4 A 10 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 186 ASN A 119 ASN~? 16.25 O3 SO4 A1146 A 260 ALA A 127 ALA~? 8.84 O3 SO4 A1146 coo 11.81 33.10 11.71 13.07 31.45 11.40 -0.83 10.88 33.15 0.71 12.12 33.87 coo 11.43 26.53 7.41 13.01 27.56 8.43 -1.94 14.59 39.42 -3.88 15.03 40.22 coo 21.53 26.33 6.96 20.26 25.69 7.52 -8.20 4.65 38.36 -8.85 5.85 37.67 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 4 hits 1r4f_c00 naa= 3 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 1 3 # 1 A 608 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 610 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 661 HIS A 79 HIS~? 16.50 O3 SO4 A1146 coo 75.99 81.56 1.86 73.91 81.34 2.28 13.54 20.21 31.37 12.47 20.57 29.56 coo 71.04 78.84 0.46 71.54 76.90 1.02 15.28 17.18 36.03 17.14 16.78 35.14 coo 75.40 81.38 12.06 74.88 79.42 12.63 4.14 13.68 32.87 3.48 14.92 34.43 1req_c10 source 1req METHYLMALONYL-COA MUTASE : 1 hits 1req_c10 naa= 3 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 1 3 # 1 C 608 ASP A 72 ASP.? 25.04 C1 GOL A1147 C 610 HIS A 71 HIS~? 22.50 O2 GOL A1148 C 661 HIS A 79 HIS~? 16.50 O3 SO4 A1146 coo -17.65 80.52 58.00 -16.23 80.79 56.41 13.54 20.21 31.37 12.47 20.57 29.56 coo -16.56 83.18 53.03 -16.33 85.18 53.60 15.28 17.18 36.03 17.14 16.78 35.14 coo -8.38 80.78 62.24 -7.53 82.67 62.02 4.14 13.68 32.87 3.48 14.92 34.43 1req_c11 source 1req METHYLMALONYL-COA MUTASE : 1 hits 1req_c11 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 6 ASP.? 21.81 O2 GOL A1148 595 GLU A 64 GLU~? 15.67 O2 GOL A1148 713 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 5.64 2.82 38.49 4.59 4.19 37.25 21.58 19.24 41.26 20.54 17.38 41.15 coo 4.35 13.73 37.63 3.39 12.18 36.55 13.54 14.68 45.68 14.95 13.29 46.42 coo 3.76 10.25 31.38 3.16 9.87 34.10 11.51 13.23 39.94 12.02 10.95 38.44 1sll_c00 source 1sll SIALIDASE L : 1 hits 1sll_c00 naa= 3 ULMN 3 1uk7_c00 3.07.01.0009 user 1 3 # 1 A 103 ALA A 67 ALA~? 21.79 O2 GOL A1148 A 224 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 252 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 11.54 19.14 41.93 12.74 19.20 42.85 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 13.54 20.21 31.37 12.47 20.57 29.56 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 15.28 17.18 36.03 17.14 16.78 35.14 1uk7_c00 source 1uk7 3.07.01.0009 : 1 hits 1uk7_c00 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 68 TYR~? 16.26 O2 GOL A1148 A 317 GLU A 64 GLU~? 15.67 O2 GOL A1148 A 365 ARG A 56 ARG~? 10.90 O2 GOL A1148 coo 1.77 6.56 57.05 3.05 7.44 59.37 11.51 13.23 39.94 12.02 10.95 38.44 coo 3.06 2.85 52.79 4.83 3.89 53.24 13.54 14.68 45.68 14.95 13.29 46.42 coo 3.82 17.09 49.56 4.09 14.32 50.84 22.32 4.42 45.18 23.04 1.62 46.30 1vzx_c02 source 1vzx 2.04.01.0087 : 1 hits 1vzx_c02 naa= 3 ULMN 3 1vzx_c03 2.04.01.0087 user 1 3 # 1 B1314 TYR A 68 TYR~? 16.26 O2 GOL A1148 B1317 GLU A 64 GLU~? 15.67 O2 GOL A1148 B1365 ARG A 56 ARG~? 10.90 O2 GOL A1148 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 11.51 13.23 39.94 12.02 10.95 38.44 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 13.54 14.68 45.68 14.95 13.29 46.42 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 22.32 4.42 45.18 23.04 1.62 46.30 1vzx_c03 source 1vzx 2.04.01.0087 : 1 hits 1vzx_c03 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 68 TYR~? 16.26 O2 GOL A1148 A 40 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 103 LEU A 69 LEU~? 21.16 O2 GOL A1148 coo 12.09 16.13 10.57 11.28 18.80 10.73 11.51 13.23 39.94 12.02 10.95 38.44 coo 7.55 25.51 14.34 9.65 25.73 14.24 13.54 20.21 31.37 12.47 20.57 29.56 coo 11.83 18.73 16.99 10.99 19.71 15.26 7.13 17.02 38.68 5.65 15.48 38.95 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 40 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 103 LEU A 125 LEU~? 10.26 O3 SO4 A1146 coo 12.09 16.13 10.57 11.28 18.80 10.73 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 7.55 25.51 14.34 9.65 25.73 14.24 -0.83 10.88 33.15 0.71 12.12 33.87 coo 11.83 18.73 16.99 10.99 19.71 15.26 -1.78 5.14 36.16 -0.28 3.55 36.22 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 40 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 103 LEU A 126 LEU~? 13.42 O3 SO4 A1146 coo 12.09 16.13 10.57 11.28 18.80 10.73 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 7.55 25.51 14.34 9.65 25.73 14.24 -0.83 10.88 33.15 0.71 12.12 33.87 coo 11.83 18.73 16.99 10.99 19.71 15.26 -4.50 5.51 40.83 -2.73 5.70 42.15 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR A 130 TYR~? 13.79 O2 SO4 A1146 A 40 ASP A 101 ASP~? 7.23 O3 GOL A1148 A 103 LEU A 103 LEU~? 10.33 O2 GOL A1148 coo 12.09 16.13 10.57 11.28 18.80 10.73 -3.37 0.40 41.39 -0.81 -0.40 40.59 coo 7.55 25.51 14.34 9.65 25.73 14.24 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 11.83 18.73 16.99 10.99 19.71 15.26 3.33 -2.84 45.85 1.94 -4.30 46.72 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 4 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 68 TYR~? 16.26 O2 GOL A1148 B 40 ASP A 72 ASP.? 25.04 C1 GOL A1147 B 103 LEU A 69 LEU~? 21.16 O2 GOL A1148 coo 14.25 20.09 37.35 13.48 17.40 37.38 11.51 13.23 39.94 12.02 10.95 38.44 coo 9.39 10.77 34.53 11.50 10.63 34.41 13.54 20.21 31.37 12.47 20.57 29.56 coo 12.89 17.60 31.13 12.34 16.51 32.90 7.13 17.02 38.68 5.65 15.48 38.95 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 40 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 103 LEU A 125 LEU~? 10.26 O3 SO4 A1146 coo 14.25 20.09 37.35 13.48 17.40 37.38 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 9.39 10.77 34.53 11.50 10.63 34.41 -0.83 10.88 33.15 0.71 12.12 33.87 coo 12.89 17.60 31.13 12.34 16.51 32.90 -1.78 5.14 36.16 -0.28 3.55 36.22 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR A 129 TYR~? 7.58 O2 SO4 A1146 B 40 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 103 LEU A 126 LEU~? 13.42 O3 SO4 A1146 coo 14.25 20.09 37.35 13.48 17.40 37.38 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 9.39 10.77 34.53 11.50 10.63 34.41 -0.83 10.88 33.15 0.71 12.12 33.87 coo 12.89 17.60 31.13 12.34 16.51 32.90 -4.50 5.51 40.83 -2.73 5.70 42.15 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR A 130 TYR~? 13.79 O2 SO4 A1146 B 40 ASP A 101 ASP~? 7.23 O3 GOL A1148 B 103 LEU A 103 LEU~? 10.33 O2 GOL A1148 coo 14.25 20.09 37.35 13.48 17.40 37.38 -3.37 0.40 41.39 -0.81 -0.40 40.59 coo 9.39 10.77 34.53 11.50 10.63 34.41 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 12.89 17.60 31.13 12.34 16.51 32.90 3.33 -2.84 45.85 1.94 -4.30 46.72 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 4 hits 1vzz_c01 naa= 3 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 1 3 # 1 A 105 HIS A 36 HIS.? 9.89 O3 GOL A1148 A 169 ASP A 101 ASP~? 7.23 O3 GOL A1148 A 288 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo 67.72 35.99 30.87 69.77 36.13 31.33 17.26 -6.17 36.90 17.14 -8.26 36.70 coo 73.17 30.66 22.56 72.87 30.30 20.46 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 74.06 28.51 15.92 73.77 29.56 17.73 -0.81 -7.81 39.86 -2.88 -7.29 39.80 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 1 hits 1w1o_c00 naa= 3 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 183 GLY A 47 GLY.? 9.15 O1 GOL A1148 B 419 GLY A 49 GLY.? 3.71 O1 GOL A1148 B 420 ALA A 54 ALA~? -3.31 O2 GOL A1148s coo 26.12 -67.67-130.71 26.18 -67.32-131.45 11.32 4.62 53.79 11.12 4.33 53.03 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 11.66 -0.07 50.74 11.88 0.60 51.26 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 15.31 1.38 47.26 14.39 0.46 48.01 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 183 GLY A 133 GLY.? 16.33 O3 SO4 A1146 B 419 GLY A 131 GLY.? 12.66 O2 SO4 A1146 B 420 ALA A 127 ALA~? 8.84 O3 SO4 A1146 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 -7.04 3.30 45.26 -6.66 3.64 44.60 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 -9.63 0.72 41.35 -9.01 1.24 41.44 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 -8.20 4.65 38.36 -8.85 5.85 37.67 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 # 3 A 183 GLY A 133 GLY.? 16.33 O3 SO4 A1146 B 419 GLY A 132 GLY.? 13.14 O3 SO4 A1146 B 420 ALA A 127 ALA~? 8.84 O3 SO4 A1146 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 -7.04 3.30 45.26 -6.66 3.64 44.60 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 -8.90 4.38 42.14 -8.57 3.76 42.54 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 -8.20 4.65 38.36 -8.85 5.85 37.67 1xny_c00 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 3 hits 1xny_c00 naa= 3 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 420 ALA A 124 ALA~? 7.24 O3 SO4 A1146 B 182 GLY A 131 GLY.? 12.66 O2 SO4 A1146 B 183 GLY A 132 GLY.? 13.14 O3 SO4 A1146 coo 38.36-101.47-135.52 39.62-101.29-136.35 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 41.93-102.35-126.87 41.52-101.89-126.30 -9.63 0.72 41.35 -9.01 1.24 41.44 coo 38.37-101.99-128.11 38.63-102.24-127.37 -8.90 4.38 42.14 -8.57 3.76 42.54 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 420 ALA A 124 ALA~? 7.24 O3 SO4 A1146 B 182 GLY A 133 GLY.? 16.33 O3 SO4 A1146 B 183 GLY A 132 GLY.? 13.14 O3 SO4 A1146 coo 38.36-101.47-135.52 39.62-101.29-136.35 -5.77 7.91 35.54 -5.54 8.44 34.13 coo 41.93-102.35-126.87 41.52-101.89-126.30 -7.04 3.30 45.26 -6.66 3.64 44.60 coo 38.37-101.99-128.11 38.63-102.24-127.37 -8.90 4.38 42.14 -8.57 3.76 42.54 1xny_c01 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 2 hits 1xny_c01 naa= 3 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 # 1 A 105 ALA A 67 ALA~? 21.79 O2 GOL A1148 A 244 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 271 HIS A 71 HIS~? 22.50 O2 GOL A1148 coo 15.05 3.71 6.93 14.58 4.88 7.78 11.54 19.14 41.93 12.74 19.20 42.85 coo 9.85 8.15 0.76 10.61 7.04 2.39 13.54 20.21 31.37 12.47 20.57 29.56 coo 10.61 7.65 6.01 12.39 6.55 6.23 15.28 17.18 36.03 17.14 16.78 35.14 1xqw_c00 source 1xqw PROLINE IMINOPEPTIDASE : 1 hits 1xqw_c00 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 B 126 ARG A 32 ARG.? 8.17 O3 AGOL A1147 B 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 2.11 4.00 19.31 3.14 4.86 19.99 5.26 -3.56 24.49 6.48 -4.47 24.30 coo 2.45 5.53 11.28 3.59 7.56 13.29 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 6.10 2.00 25.24 6.12 1.84 23.13 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 B 126 ARG A 91 ARG.? 9.03 O3 AGOL A1147 B 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 2.11 4.00 19.31 3.14 4.86 19.99 5.26 -3.56 24.49 6.48 -4.47 24.30 coo 2.45 5.53 11.28 3.59 7.56 13.29 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 6.10 2.00 25.24 6.12 1.84 23.13 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 B 124 ALA A 115 ALA~? 20.18 O2 GOL A1148 B 126 ARG A 114 ARG~? 22.43 O3 SO4 A1146 B 138 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 2.11 4.00 19.31 3.14 4.86 19.99 2.93 16.36 44.39 4.19 15.74 43.78 coo 2.45 5.53 11.28 3.59 7.56 13.29 -2.08 13.07 47.90 -4.47 12.15 49.60 coo 6.10 2.00 25.24 6.12 1.84 23.13 9.23 20.68 49.62 8.18 19.72 51.22 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 3 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 C 126 ARG A 32 ARG.? 8.17 O3 AGOL A1147 C 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 5.26 -3.56 24.49 6.48 -4.47 24.30 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 5.64 -9.61 30.19 6.78 -11.86 28.47 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 C 126 ARG A 91 ARG.? 9.03 O3 AGOL A1147 C 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 5.26 -3.56 24.49 6.48 -4.47 24.30 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA A 115 ALA~? 20.18 O2 GOL A1148 C 126 ARG A 114 ARG~? 22.43 O3 SO4 A1146 C 138 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 2.93 16.36 44.39 4.19 15.74 43.78 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -2.08 13.07 47.90 -4.47 12.15 49.60 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 9.23 20.68 49.62 8.18 19.72 51.22 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 3 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 D 126 ARG A 32 ARG.? 8.17 O3 AGOL A1147 D 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 2.08 -1.49 62.94 3.12 -2.39 62.28 5.26 -3.56 24.49 6.48 -4.47 24.30 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 6.23 0.50 57.10 5.93 0.72 59.19 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 D 126 ARG A 91 ARG.? 9.03 O3 AGOL A1147 D 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo 2.08 -1.49 62.94 3.12 -2.39 62.28 5.26 -3.56 24.49 6.48 -4.47 24.30 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 6.23 0.50 57.10 5.93 0.72 59.19 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA A 115 ALA~? 20.18 O2 GOL A1148 D 126 ARG A 114 ARG~? 22.43 O3 SO4 A1146 D 138 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 2.93 16.36 44.39 4.19 15.74 43.78 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -2.08 13.07 47.90 -4.47 12.15 49.60 coo 6.23 0.50 57.10 5.93 0.72 59.19 9.23 20.68 49.62 8.18 19.72 51.22 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 3 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 E 126 ARG A 32 ARG.? 8.17 O3 AGOL A1147 E 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo -4.56 10.03 62.36 -4.38 11.31 61.55 5.26 -3.56 24.49 6.48 -4.47 24.30 coo -3.02 12.00 70.07 -1.94 13.84 67.82 5.64 -9.61 30.19 6.78 -11.86 28.47 coo -8.67 12.22 56.54 -8.68 12.09 58.65 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 E 126 ARG A 91 ARG.? 9.03 O3 AGOL A1147 E 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo -4.56 10.03 62.36 -4.38 11.31 61.55 5.26 -3.56 24.49 6.48 -4.47 24.30 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo -8.67 12.22 56.54 -8.68 12.09 58.65 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA A 115 ALA~? 20.18 O2 GOL A1148 E 126 ARG A 114 ARG~? 22.43 O3 SO4 A1146 E 138 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo -4.56 10.03 62.36 -4.38 11.31 61.55 2.93 16.36 44.39 4.19 15.74 43.78 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -2.08 13.07 47.90 -4.47 12.15 49.60 coo -8.67 12.22 56.54 -8.68 12.09 58.65 9.23 20.68 49.62 8.18 19.72 51.22 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 3 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 F 126 ARG A 32 ARG.? 8.17 O3 AGOL A1147 F 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 5.26 -3.56 24.49 6.48 -4.47 24.30 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 5.64 -9.61 30.19 6.78 -11.86 28.47 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 30 ALA~? 3.84 O3 AGOL A1147 F 126 ARG A 91 ARG.? 9.03 O3 AGOL A1147 F 138 GLU A 26 GLU~? -5.34 O3 BGOL A1147s coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 5.26 -3.56 24.49 6.48 -4.47 24.30 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 12.58 -0.11 23.07 11.74 0.33 21.17 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA A 115 ALA~? 20.18 O2 GOL A1148 F 126 ARG A 114 ARG~? 22.43 O3 SO4 A1146 F 138 GLU A 63 GLU~? 22.88 O2 GOL A1148 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 2.93 16.36 44.39 4.19 15.74 43.78 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -2.08 13.07 47.90 -4.47 12.15 49.60 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 9.23 20.68 49.62 8.18 19.72 51.22 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 3 hits 1xs1_c11 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY A 49 GLY.? 3.71 O1 GOL A1148 B 175 ARG A 46 ARG.? 13.13 O2 GOL A1148 B 242 TYR A 57 TYR~? 10.51 O2 GOL A1148 coo 99.45 58.28 3.33 99.57 58.61 4.10 11.66 -0.07 50.74 11.88 0.60 51.26 coo 106.37 63.53 0.89 108.02 63.40 -1.62 15.67 8.12 51.97 17.20 9.77 49.88 coo 100.93 69.04 4.38 99.52 68.48 2.09 17.76 5.01 42.82 20.23 4.84 41.52 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 # 2 B 137 GLY A 58 GLY.? 9.16 O2 GOL A1148 B 175 ARG A 12 ARG~? 14.35 O2 GOL A1148 B 242 TYR A 68 TYR~? 16.26 O2 GOL A1148 coo 99.45 58.28 3.33 99.57 58.61 4.10 13.89 6.85 47.31 14.44 7.38 46.94 coo 106.37 63.53 0.89 108.02 63.40 -1.62 19.79 9.88 44.03 17.28 11.31 45.11 coo 100.93 69.04 4.38 99.52 68.48 2.09 11.51 13.23 39.94 12.02 10.95 38.44 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 3 3 # 3 B 137 GLY A 98 GLY.? 12.12 O3 GOL A1148 B 175 ARG A 91 ARG.? 9.03 O3 AGOL A1147 B 242 TYR A 129 TYR~? 7.58 O2 SO4 A1146 coo 99.45 58.28 3.33 99.57 58.61 4.10 5.16 -8.51 38.23 5.32 -7.71 38.47 coo 106.37 63.53 0.89 108.02 63.40 -1.62 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 100.93 69.04 4.38 99.52 68.48 2.09 -3.64 -0.29 35.50 -3.07 -0.43 32.77 1xva_c03 source 1xva GLYCINE N-METHYLTRANSFERASE : 3 hits 1xva_c03 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 37 TRP~? 7.86 O1 GOL A1147 223 ASP A 101 ASP~? 7.23 O3 GOL A1148 258 ALA A 30 ALA~? 3.84 O3 AGOL A1147 coo 128.40 33.01 26.67 128.12 36.28 28.81 14.43 -1.35 33.32 10.60 -0.46 33.68 coo 127.91 41.73 23.55 129.18 40.35 24.44 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 141.00 37.49 25.74 139.80 37.53 24.78 5.26 -3.56 24.49 6.48 -4.47 24.30 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP A 37 TRP~? 7.86 O1 GOL A1147 223 ASP A 101 ASP~? 7.23 O3 GOL A1148 258 ALA A 54 ALA~? -3.31 O2 GOL A1148s coo 128.40 33.01 26.67 128.12 36.28 28.81 14.43 -1.35 33.32 10.60 -0.46 33.68 coo 127.91 41.73 23.55 129.18 40.35 24.44 7.29 -4.04 39.78 9.37 -4.30 39.92 coo 141.00 37.49 25.74 139.80 37.53 24.78 15.31 1.38 47.26 14.39 0.46 48.01 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 2 hits 2aat_c01 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG A 136 ARG~? 19.45 O1 GOL A1148 A 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 -3.07 1.25 54.96 -5.99 1.43 53.92 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 -3.37 0.40 41.39 -0.81 -0.40 40.59 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG A 137 ARG~? 7.86 O1 GOL A1148 A 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 3.45 0.43 53.78 6.50 0.05 53.66 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 -3.37 0.40 41.39 -0.81 -0.40 40.59 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 2 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 136 ARG~? 19.45 O1 GOL A1148 B 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 B 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 -3.07 1.25 54.96 -5.99 1.43 53.92 coo -14.86 10.19 8.14 -14.82 12.31 8.42 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -21.46 12.70 8.53 -19.04 12.30 7.24 -3.37 0.40 41.39 -0.81 -0.40 40.59 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG A 137 ARG~? 7.86 O1 GOL A1148 B 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 B 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 3.45 0.43 53.78 6.50 0.05 53.66 coo -14.86 10.19 8.14 -14.82 12.31 8.42 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -21.46 12.70 8.53 -19.04 12.30 7.24 -3.37 0.40 41.39 -0.81 -0.40 40.59 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 2 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 136 ARG~? 19.45 O1 GOL A1148 C 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 C 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo 2.84 19.43 40.34 1.59 20.35 37.65 -3.07 1.25 54.96 -5.99 1.43 53.92 coo -0.62 11.10 28.05 -0.65 13.15 27.46 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 5.94 13.28 27.17 3.53 13.05 28.58 -3.37 0.40 41.39 -0.81 -0.40 40.59 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG A 137 ARG~? 7.86 O1 GOL A1148 C 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 C 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo 2.84 19.43 40.34 1.59 20.35 37.65 3.45 0.43 53.78 6.50 0.05 53.66 coo -0.62 11.10 28.05 -0.65 13.15 27.46 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 5.94 13.28 27.17 3.53 13.05 28.58 -3.37 0.40 41.39 -0.81 -0.40 40.59 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 2 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG A 136 ARG~? 19.45 O1 GOL A1148 D 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 D 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 -3.07 1.25 54.96 -5.99 1.43 53.92 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 -3.37 0.40 41.39 -0.81 -0.40 40.59 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG A 137 ARG~? 7.86 O1 GOL A1148 D 161 ASP A 102 ASP~? 12.37 O2 GOL A1148 D 174 TYR A 130 TYR~? 13.79 O2 SO4 A1146 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 3.45 0.43 53.78 6.50 0.05 53.66 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 -3.37 0.40 41.39 -0.81 -0.40 40.59 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 2 hits 2c7v_c11 naa= 3 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 150 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 245 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 273 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 8.51 -4.81 32.23 11.26 -4.33 37.14 2gsa_c02 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 1 hits 2gsa_c02 naa= 3 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 157 PHE A 112 PHE~? 15.88 O2 GOL A1148 A 245 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 273 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 9.49 9.24 -34.27 7.12 7.86 -33.75 5.53 11.51 41.12 8.31 11.34 41.51 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 -0.83 10.88 33.15 0.71 12.12 33.87 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 -7.58 2.17 35.54 -5.66 0.99 29.63 2gsa_c04 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 1 hits 2gsa_c04 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 42 PHE~? 13.86 O2 GOL A1148 A 263 ASP A 102 ASP~? 12.37 O2 GOL A1148 A 292 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 51.51 50.32 16.39 52.13 49.68 13.75 7.20 3.94 37.34 6.03 3.85 34.80 coo 54.43 44.82 23.74 55.21 45.06 21.80 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 63.95 45.30 16.71 59.11 49.15 16.05 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 177 PHE A 42 PHE~? 13.86 O2 GOL A1148 A 263 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 292 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 51.51 50.32 16.39 52.13 49.68 13.75 7.20 3.94 37.34 6.03 3.85 34.80 coo 54.43 44.82 23.74 55.21 45.06 21.80 -0.83 10.88 33.15 0.71 12.12 33.87 coo 63.95 45.30 16.71 59.11 49.15 16.05 -7.58 2.17 35.54 -5.66 0.99 29.63 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c03 naa= 3 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 177 PHE A 42 PHE~? 13.86 O2 GOL A1148 B 263 ASP A 102 ASP~? 12.37 O2 GOL A1148 B 292 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 49.99 26.05 6.28 51.46 26.87 8.49 7.20 3.94 37.34 6.03 3.85 34.80 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 60.53 31.67 0.97 57.79 27.51 3.63 -7.58 2.17 35.54 -5.66 0.99 29.63 2oat_c04 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c04 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 42 PHE~? 13.86 O2 GOL A1148 C 263 ASP A 102 ASP~? 12.37 O2 GOL A1148 C 292 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 21.96 11.84 -0.03 20.04 11.74 -2.01 7.20 3.94 37.34 6.03 3.85 34.80 coo 19.84 12.02 9.33 18.68 11.23 7.75 1.78 -4.59 40.98 1.81 -5.91 42.65 coo 12.82 3.49 4.98 17.80 5.59 1.90 -7.58 2.17 35.54 -5.66 0.99 29.63 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 177 PHE A 42 PHE~? 13.86 O2 GOL A1148 C 263 ASP A 121 ASP~? 13.01 O3 SO4 A1146 C 292 LYS A 128 LYS~? -2.87 O2 SO4 A1146s coo 21.96 11.84 -0.03 20.04 11.74 -2.01 7.20 3.94 37.34 6.03 3.85 34.80 coo 19.84 12.02 9.33 18.68 11.23 7.75 -0.83 10.88 33.15 0.71 12.12 33.87 coo 12.82 3.49 4.98 17.80 5.59 1.90 -7.58 2.17 35.54 -5.66 0.99 29.63 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c05 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 135 ASP~? 12.04 O1 GOL A1148 A 151 LYS A 104 LYS~? -2.54 O2 GOL A1148s A 186 THR A 110 THR~? 16.16 O2 GOL A1148 coo 41.42 17.90 44.98 43.39 18.36 45.61 0.67 3.61 47.99 2.00 2.44 49.10 coo 45.75 16.58 39.61 47.43 18.26 45.54 6.01 0.08 43.69 10.87 -1.21 45.63 coo 45.88 23.02 44.72 46.99 21.16 44.68 0.29 8.02 44.77 -0.51 6.84 46.38 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 102 ASP~? 12.37 O2 GOL A1148 166 GLY A 58 GLY.? 9.16 O2 GOL A1148 169 GLU A 64 GLU~? 15.67 O2 GOL A1148 coo 8.28 6.87 1.62 10.08 5.77 1.34 1.78 -4.59 40.98 1.81 -5.91 42.65 coo -8.58 13.22 3.21 -8.90 13.15 4.05 13.89 6.85 47.31 14.44 7.38 46.94 coo -16.67 7.89 2.78 -17.65 6.56 1.49 13.54 14.68 45.68 14.95 13.29 46.42 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 1 hits 2tdt_c00 naa= 3 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 A 169 TYR A 68 TYR~? 16.26 O2 GOL A1148 A 172 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 267 ASP A 72 ASP.? 25.04 C1 GOL A1147 coo 26.78 20.44 0.03 28.51 18.26 0.09 11.51 13.23 39.94 12.02 10.95 38.44 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 15.28 17.18 36.03 17.14 16.78 35.14 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 13.54 20.21 31.37 12.47 20.57 29.56 2tmd_c00 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 1 hits 2tmd_c00 naa= 3 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 B 169 TYR A 68 TYR~? 16.26 O2 GOL A1148 B 172 HIS A 71 HIS~? 22.50 O2 GOL A1148 B 267 ASP A 72 ASP.? 25.04 C1 GOL A1147 coo 44.86 1.98 33.27 42.75 1.12 31.67 11.51 13.23 39.94 12.02 10.95 38.44 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 15.28 17.18 36.03 17.14 16.78 35.14 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 13.54 20.21 31.37 12.47 20.57 29.56 2tmd_c01 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 1 hits 2tmd_c01 naa= 3 ULMN 3 2tps_c00 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 A 59 ARG A 12 ARG~? 14.35 O2 GOL A1148 A 130 SER A 60 SER.? 16.93 O2 GOL A1148 A 159 LYS A 11 LYS~? 21.22 O2 GOL A1148 coo 18.35 45.84 20.99 16.20 47.83 21.89 19.79 9.88 44.03 17.28 11.31 45.11 coo 15.14 43.67 10.77 15.61 44.43 13.04 13.07 12.22 50.34 14.07 14.38 49.84 coo 11.57 48.49 22.18 13.51 49.99 17.21 21.22 13.78 38.77 26.11 13.41 41.35 ULMN 3 2tps_c00 THIAMIN PHOSPHATE SYNTHASE user 2 3 # 2 A 59 ARG A 32 ARG.? 8.17 O3 AGOL A1147 A 130 SER A 92 SER~? 13.14 O2 SO4 A1146 A 159 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 18.35 45.84 20.99 16.20 47.83 21.89 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 15.14 43.67 10.77 15.61 44.43 13.04 -4.00 -6.25 34.54 -3.33 -8.31 35.64 coo 11.57 48.49 22.18 13.51 49.99 17.21 8.51 -4.81 32.23 11.26 -4.33 37.14 2tps_c00 source 2tps THIAMIN PHOSPHATE SYNTHASE : 2 hits 2tps_c00 naa= 3 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 B 59 ARG A 12 ARG~? 14.35 O2 GOL A1148 B 130 SER A 60 SER.? 16.93 O2 GOL A1148 B 159 LYS A 11 LYS~? 21.22 O2 GOL A1148 coo 58.72 31.58 20.45 60.80 29.39 20.94 19.79 9.88 44.03 17.28 11.31 45.11 coo 61.66 35.17 10.39 61.29 34.14 12.56 13.07 12.22 50.34 14.07 14.38 49.84 coo 65.38 28.77 21.17 63.49 28.03 16.12 21.22 13.78 38.77 26.11 13.41 41.35 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 2 3 # 2 B 59 ARG A 32 ARG.? 8.17 O3 AGOL A1147 B 130 SER A 92 SER~? 13.14 O2 SO4 A1146 B 159 LYS A 33 LYS.? 8.85 O3 GOL A1148 coo 58.72 31.58 20.45 60.80 29.39 20.94 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 61.66 35.17 10.39 61.29 34.14 12.56 -4.00 -6.25 34.54 -3.33 -8.31 35.64 coo 65.38 28.77 21.17 63.49 28.03 16.12 8.51 -4.81 32.23 11.26 -4.33 37.14 2tps_c01 source 2tps THIAMIN PHOSPHATE SYNTHASE : 2 hits 2tps_c01 naa= 3 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 1 3 # 1 71 ARG A 32 ARG.? 8.17 O3 AGOL A1147 127 ARG A 91 ARG.? 9.03 O3 AGOL A1147 270 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo -1.14 25.72 1.64 0.76 28.10 1.50 5.64 -9.61 30.19 6.78 -11.86 28.47 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 -0.81 -7.81 39.86 -2.88 -7.29 39.80 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 2 3 # 2 71 ARG A 91 ARG.? 9.03 O3 AGOL A1147 127 ARG A 32 ARG.? 8.17 O3 AGOL A1147 270 GLU A 94 GLU~? 15.24 O2 SO4 A1146 coo -1.14 25.72 1.64 0.76 28.10 1.50 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 5.64 -9.61 30.19 6.78 -11.86 28.47 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 -0.81 -7.81 39.86 -2.88 -7.29 39.80 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 3 3 # 3 71 ARG A 136 ARG~? 19.45 O1 GOL A1148 127 ARG A 137 ARG~? 7.86 O1 GOL A1148 270 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -1.14 25.72 1.64 0.76 28.10 1.50 -3.07 1.25 54.96 -5.99 1.43 53.92 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 3.45 0.43 53.78 6.50 0.05 53.66 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 -4.46 7.21 46.33 -4.54 9.09 47.28 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 4 3 # 4 71 ARG A 137 ARG~? 7.86 O1 GOL A1148 127 ARG A 136 ARG~? 19.45 O1 GOL A1148 270 GLU A 134 GLU.? 19.30 O3 SO4 A1146 coo -1.14 25.72 1.64 0.76 28.10 1.50 3.45 0.43 53.78 6.50 0.05 53.66 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 -3.07 1.25 54.96 -5.99 1.43 53.92 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 -4.46 7.21 46.33 -4.54 9.09 47.28 5cpa_c01 source 5cpa CARBOXYPEPTIDASE A=ALPHA= (COX) (E.C.3.4.17.1): 4 hits 5cpa_c01 naa= 3 ULMN 3 8pch_c00 CATHEPSIN H user 1 3 # 1 A 25 CYH A 81 CYH~? 12.40 C1 GOL A1147 A 159 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 175 ASN A 86 ASN~? -7.27 O3 SO4 A1146s coo 17.05 13.18 22.45 14.62 11.74 22.22 6.31 6.18 31.19 9.06 5.87 31.56 coo 11.41 9.68 19.45 11.30 7.64 19.91 4.14 13.68 32.87 3.48 14.92 34.43 coo 18.02 12.10 14.04 16.52 11.22 15.25 -2.38 5.31 30.77 -2.40 5.93 32.80 8pch_c00 source 8pch CATHEPSIN H : 1 hits 8pch_c00 naa= 3 ULMN 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 # 1 A 81 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 99 GLY A 83 GLY~? 9.44 O4 SO4 A1146 A 125 ASN A 86 ASN~? -7.27 O3 SO4 A1146s coo -12.71 41.15 -12.81 -13.46 42.96 -13.57 -0.83 10.88 33.15 0.71 12.12 33.87 coo -9.98 44.30 -14.04 -9.74 44.63 -13.34 1.28 7.34 29.60 1.75 6.71 29.80 coo -9.28 44.56 -19.45 -10.46 44.31 -17.70 -2.38 5.31 30.77 -2.40 5.93 32.80 1hkd_p00 source 1hkd PEA LECTIN ALPHA CHAIN : 1 hits 1hkd_p00 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 86 ASN~? -7.27 O3 SO4 A1146s coo 5.80 63.03 55.85 5.52 65.03 56.45 -2.38 5.31 30.77 -2.40 5.93 32.80 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 119 ASN~? 16.25 O3 SO4 A1146 coo 5.80 63.03 55.85 5.52 65.03 56.45 -1.94 14.59 39.42 -3.88 15.03 40.22 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 2 hits 1kbk_p00 naa= 1 ULMN 4 1kqr_p00 VP4 user 1 4 # 1 A 101 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 187 LYS A 128 LYS~? -2.87 O2 SO4 A1146s A 188 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 190 SER A 92 SER~? 13.14 O2 SO4 A1146 coo 10.93 40.49 13.39 9.72 39.25 15.90 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 2.71 31.72 11.75 7.91 29.74 9.11 -7.58 2.17 35.54 -5.66 0.99 29.63 coo 1.39 36.04 13.60 -0.23 35.82 15.85 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 4.80 41.21 15.27 3.05 40.92 16.89 -4.00 -6.25 34.54 -3.33 -8.31 35.64 1kqr_p00 source 1kqr VP4 : 1 hits 1kqr_p00 naa= 4 ULMN 3 2p3i_p00 VP4 user 1 3 # 1 A 101 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 188 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 190 SER A 92 SER~? 13.14 O2 SO4 A1146 coo 37.69 7.64 13.51 38.82 8.84 16.11 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 47.14 12.10 13.73 48.75 12.33 16.01 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 43.77 6.93 15.46 45.49 7.21 17.11 -4.00 -6.25 34.54 -3.33 -8.31 35.64 2p3i_p00 source 2p3i VP4 : 1 hits 2p3i_p00 naa= 3 ULMN 4 2p3k_p00 VP4 user 1 4 # 1 A 101 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 187 LYS A 128 LYS~? -2.87 O2 SO4 A1146s A 188 TYR A 129 TYR~? 7.58 O2 SO4 A1146 A 190 SER A 92 SER~? 13.14 O2 SO4 A1146 coo 37.00 7.53 13.18 38.22 8.80 15.70 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 45.42 16.25 11.76 45.82 18.39 15.98 -7.58 2.17 35.54 -5.66 0.99 29.63 coo 46.58 11.94 13.55 48.24 12.22 15.76 -3.64 -0.29 35.50 -3.07 -0.43 32.77 coo 43.09 6.80 15.14 44.84 7.11 16.79 -4.00 -6.25 34.54 -3.33 -8.31 35.64 2p3k_p00 source 2p3k VP4 : 1 hits 2p3k_p00 naa= 4 ULMN 3 1b01_d00 GENE REGULATION/DNA user 1 3 # 1 B 4 ARG A 136 ARG~? 19.45 O1 GOL A1148 B 6 THR A 138 THR~? 13.50 O2 GOL A1148 B 8 THR A 110 THR~? 16.16 O2 GOL A1148 coo 40.52 16.08 100.90 37.97 16.41 102.60 -3.07 1.25 54.96 -5.99 1.43 53.92 coo 36.11 13.64 95.03 34.54 14.86 95.91 2.60 6.80 51.03 3.21 6.96 48.95 coo 32.72 8.05 92.39 31.25 9.11 91.35 0.29 8.02 44.77 -0.51 6.84 46.38 ULMN 3 1b01_d00 GENE REGULATION/DNA user 2 3 # 2 B 4 ARG A 137 ARG~? 7.86 O1 GOL A1148 B 6 THR A 138 THR~? 13.50 O2 GOL A1148 B 8 THR A 110 THR~? 16.16 O2 GOL A1148 coo 40.52 16.08 100.90 37.97 16.41 102.60 3.45 0.43 53.78 6.50 0.05 53.66 coo 36.11 13.64 95.03 34.54 14.86 95.91 2.60 6.80 51.03 3.21 6.96 48.95 coo 32.72 8.05 92.39 31.25 9.11 91.35 0.29 8.02 44.77 -0.51 6.84 46.38 1b01_d00 source 1b01 GENE REGULATION/DNA : 2 hits 1b01_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 7 PRO.? 24.36 O2 GOL A1148 A 272 LEU A 10 LEU~? 19.34 O2 GOL A1148 A 276 ARG A 12 ARG~? 14.35 O2 GOL A1148 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 18.25 21.96 45.19 19.99 20.55 45.11 coo 10.97 0.43 16.73 11.31 2.11 18.06 17.23 15.55 40.31 15.32 16.09 41.22 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 19.79 9.88 44.03 17.28 11.31 45.11 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO A 43 PRO.? 11.38 O2 GOL A1148 A 272 LEU A 78 LEU~? 17.14 O2 GOL A1148 A 276 ARG A 77 ARG~? 14.83 O1 GOL A1147 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 11.36 8.10 40.55 10.05 6.48 41.39 coo 10.97 0.43 16.73 11.31 2.11 18.06 7.84 10.76 35.51 7.05 9.79 37.31 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 13.84 10.22 30.84 16.69 9.80 29.81 ULMN 3 1emh_d00 HYDROLASE/DNA user 3 3 # 3 A 271 PRO A 100 PRO~? 6.77 O3 GOL A1148 A 272 LEU A 103 LEU~? 10.33 O2 GOL A1148 A 276 ARG A 137 ARG~? 7.86 O1 GOL A1148 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 8.68 -6.57 44.51 6.70 -6.99 43.52 coo 10.97 0.43 16.73 11.31 2.11 18.06 3.33 -2.84 45.85 1.94 -4.30 46.72 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 3.45 0.43 53.78 6.50 0.05 53.66 1emh_d00 source 1emh HYDROLASE/DNA : 3 hits 1emh_d00 naa= 3 ULMN 3 2bsq_d00 TRANSCRIPTION user 1 3 # 1 E 3 SER A 50 SER.? -4.37 O1 GOL A1148s E 5 VAL A 55 VAL~? 7.94 C1 GOL A1148 E 7 ARG A 56 ARG~? 10.90 O2 GOL A1148 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 14.71 -0.94 52.81 14.26 -3.10 53.83 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 16.83 3.80 49.80 17.47 3.58 51.89 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 22.32 4.42 45.18 23.04 1.62 46.30 ULMN 3 2bsq_d00 TRANSCRIPTION user 2 3 # 2 E 3 SER A 51 SER~? -3.40 C1 GOL A1148s E 5 VAL A 55 VAL~? 7.94 C1 GOL A1148 E 7 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 17.26 -2.27 50.29 16.41 -2.20 48.03 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 16.83 3.80 49.80 17.47 3.58 51.89 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 15.67 8.12 51.97 17.20 9.77 49.88 ULMN 3 2bsq_d00 TRANSCRIPTION user 3 3 # 3 E 3 SER A 107 SER~? 9.91 O2 GOL A1148 E 5 VAL A 139 VAL~? 18.75 O1 GOL A1148 E 7 ARG A 114 ARG~? 22.43 O3 SO4 A1146 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 3.37 4.04 45.55 4.05 2.30 47.09 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 -0.52 8.78 52.00 -2.65 8.79 51.39 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 -2.08 13.07 47.90 -4.47 12.15 49.60 2bsq_d00 source 2bsq TRANSCRIPTION : 3 hits 2bsq_d00 naa= 3 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 24 ARG A 34 ARG.? 5.20 O3 AGOL A1147 A 32 LYS A 33 LYS.? 8.85 O3 GOL A1148 A 46 ARG A 22 ARG~? 9.54 O3 BGOL A1147 coo -8.00 4.27 27.74 -7.09 2.66 30.09 11.31 -8.21 28.23 9.62 -10.21 26.60 coo -5.15 8.65 26.69 -4.26 5.48 32.02 8.51 -4.81 32.23 11.26 -4.33 37.14 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 14.87 3.60 22.71 13.15 4.40 20.32 2ky8_d00 source 2ky8 TRANSCRIPTION/DNA : 1 hits 2ky8_d00 naa= 3 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 1 4 # 1 B 122 ARG A 34 ARG.? 5.20 O3 AGOL A1147 B 148 LYS A 104 LYS~? -2.54 O2 GOL A1148s B 151 LEU A 105 LEU~? 13.11 O2 GOL A1148 B 154 ILE A 93 ILE~? 12.05 O2 SO4 A1146 coo 13.00 32.05 60.31 16.02 31.73 59.80 11.31 -8.21 28.23 9.62 -10.21 26.60 coo 11.05 44.13 44.68 12.77 44.45 49.56 6.01 0.08 43.69 10.87 -1.21 45.63 coo 11.72 38.91 44.77 13.11 39.67 46.23 3.48 0.88 39.62 3.01 1.86 37.72 coo 7.03 36.97 46.99 7.83 37.90 47.52 -1.37 -3.18 37.26 -0.81 -2.62 37.25 3odc_d00 source 3odc DNA BINDING PROTEIN/DNA : 1 hits 3odc_d00 naa= 4 ULMN 3 3pta_d00 TRANSFERASE/DNA user 1 3 # 1 A 682 SER A 107 SER~? 9.91 O2 GOL A1148 A 683 LYS A 104 LYS~? -2.54 O2 GOL A1148s A 684 GLN A 44 GLN.? 5.86 O2 GOL A1148 coo -8.24 -20.23 36.50 -7.44 -18.27 37.68 3.37 4.04 45.55 4.05 2.30 47.09 coo -5.30 -22.52 37.30 -6.47 -26.26 32.30 6.01 0.08 43.69 10.87 -1.21 45.63 coo -3.80 -18.22 38.13 -1.93 -17.88 37.17 9.32 3.81 46.33 8.65 1.84 46.71 3pta_d00 source 3pta TRANSFERASE/DNA : 1 hits 3pta_d00 naa= 3 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 78 ARG A 12 ARG~? 14.35 O2 GOL A1148 A 82 LYS A 11 LYS~? 21.22 O2 GOL A1148 A 97 ARG A 46 ARG.? 13.13 O2 GOL A1148 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 19.79 9.88 44.03 17.28 11.31 45.11 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 21.22 13.78 38.77 26.11 13.41 41.35 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 15.67 8.12 51.97 17.20 9.77 49.88 4er8_d00 source 4er8 DNA BINDING PROTEIN/DNA : 1 hits 4er8_d00 naa= 3 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 C 61 LYS A 128 LYS~? -2.87 O2 SO4 A1146s C 90 HIS A 79 HIS~? 16.50 O3 SO4 A1146 C 91 GLN A 120 GLN~? 14.46 O3 SO4 A1146 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 -7.58 2.17 35.54 -5.66 0.99 29.63 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 4.14 13.68 32.87 3.48 14.92 34.43 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 -3.87 14.85 33.19 -3.17 16.84 33.63 4hp3_d00 source 4hp3 DNA BINDING PROTEIN/DNA : 1 hits 4hp3_d00 naa= 3 ULMN 3 1ukf_o00 AVIRULENCE PROTEIN AVRPPH3 user 1 3 # 1 A 98 CYH A 81 CYH~? 12.40 C1 GOL A1147 A 212 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 227 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo 32.24 40.70 41.87 34.94 39.83 42.22 6.31 6.18 31.19 9.06 5.87 31.56 coo 35.63 37.64 46.24 33.55 37.41 46.24 4.14 13.68 32.87 3.48 14.92 34.43 coo 30.05 37.79 50.12 31.66 36.75 49.22 -0.83 10.88 33.15 0.71 12.12 33.87 1ukf_o00 source 1UKF AVIRULENCE PROTEIN AVRPPH3 : 1 hits 1ukf_o00 naa= 3 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 1 3 # 1 A 130 SER A 60 SER.? 16.93 O2 GOL A1148 A 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 A 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -46.28 37.24 81.97 -44.96 39.32 82.40 13.07 12.22 50.34 14.07 14.38 49.84 coo -36.62 39.62 84.60 -38.76 41.24 85.25 16.15 9.89 40.11 15.07 9.53 42.65 coo -36.55 45.66 79.22 -38.34 43.94 80.53 16.78 3.97 38.41 17.89 1.85 36.97 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 2 3 # 2 A 130 SER A 107 SER~? 9.91 O2 GOL A1148 A 166 PHE A 42 PHE~? 13.86 O2 GOL A1148 A 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -46.28 37.24 81.97 -44.96 39.32 82.40 3.37 4.04 45.55 4.05 2.30 47.09 coo -36.62 39.62 84.60 -38.76 41.24 85.25 7.20 3.94 37.34 6.03 3.85 34.80 coo -36.55 45.66 79.22 -38.34 43.94 80.53 16.78 3.97 38.41 17.89 1.85 36.97 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 3 3 # 3 A 130 SER A 107 SER~? 9.91 O2 GOL A1148 A 166 PHE A 42 PHE~? 13.86 O2 GOL A1148 A 182 PHE A 97 PHE~? 12.37 O3 AGOL A1147 coo -46.28 37.24 81.97 -44.96 39.32 82.40 3.37 4.04 45.55 4.05 2.30 47.09 coo -36.62 39.62 84.60 -38.76 41.24 85.25 7.20 3.94 37.34 6.03 3.85 34.80 coo -36.55 45.66 79.22 -38.34 43.94 80.53 4.68 -2.71 36.32 5.13 -0.43 34.81 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 4 3 # 4 A 130 SER A 108 SER~? 12.49 O2 GOL A1148 A 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 A 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -46.28 37.24 81.97 -44.96 39.32 82.40 4.99 6.08 42.77 6.34 6.55 40.80 coo -36.62 39.62 84.60 -38.76 41.24 85.25 16.15 9.89 40.11 15.07 9.53 42.65 coo -36.55 45.66 79.22 -38.34 43.94 80.53 16.78 3.97 38.41 17.89 1.85 36.97 2r11_o00 source 2R11 CARBOXYLESTERASE NP : 4 hits 2r11_o00 naa= 3 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 1 3 # 1 B 130 SER A 60 SER.? 16.93 O2 GOL A1148 B 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 B 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -19.94 46.29 97.83 -22.38 46.56 97.60 13.07 12.22 50.34 14.07 14.38 49.84 coo -29.59 43.40 95.66 -28.22 45.54 94.50 16.15 9.89 40.11 15.07 9.53 42.65 coo -32.72 50.15 98.46 -30.32 48.85 97.77 16.78 3.97 38.41 17.89 1.85 36.97 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 2 3 # 2 B 130 SER A 92 SER~? 13.14 O2 SO4 A1146 B 166 PHE A 97 PHE~? 12.37 O3 AGOL A1147 B 182 PHE A 42 PHE~? 13.86 O2 GOL A1148 coo -19.94 46.29 97.83 -22.38 46.56 97.60 -4.00 -6.25 34.54 -3.33 -8.31 35.64 coo -29.59 43.40 95.66 -28.22 45.54 94.50 4.68 -2.71 36.32 5.13 -0.43 34.81 coo -32.72 50.15 98.46 -30.32 48.85 97.77 7.20 3.94 37.34 6.03 3.85 34.80 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 3 3 # 3 B 130 SER A 107 SER~? 9.91 O2 GOL A1148 B 166 PHE A 42 PHE~? 13.86 O2 GOL A1148 B 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -19.94 46.29 97.83 -22.38 46.56 97.60 3.37 4.04 45.55 4.05 2.30 47.09 coo -29.59 43.40 95.66 -28.22 45.54 94.50 7.20 3.94 37.34 6.03 3.85 34.80 coo -32.72 50.15 98.46 -30.32 48.85 97.77 16.78 3.97 38.41 17.89 1.85 36.97 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 4 3 # 4 B 130 SER A 107 SER~? 9.91 O2 GOL A1148 B 166 PHE A 42 PHE~? 13.86 O2 GOL A1148 B 182 PHE A 97 PHE~? 12.37 O3 AGOL A1147 coo -19.94 46.29 97.83 -22.38 46.56 97.60 3.37 4.04 45.55 4.05 2.30 47.09 coo -29.59 43.40 95.66 -28.22 45.54 94.50 7.20 3.94 37.34 6.03 3.85 34.80 coo -32.72 50.15 98.46 -30.32 48.85 97.77 4.68 -2.71 36.32 5.13 -0.43 34.81 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 5 3 # 5 B 130 SER A 108 SER~? 12.49 O2 GOL A1148 B 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 B 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -19.94 46.29 97.83 -22.38 46.56 97.60 4.99 6.08 42.77 6.34 6.55 40.80 coo -29.59 43.40 95.66 -28.22 45.54 94.50 16.15 9.89 40.11 15.07 9.53 42.65 coo -32.72 50.15 98.46 -30.32 48.85 97.77 16.78 3.97 38.41 17.89 1.85 36.97 2r11_o01 source 2R11 CARBOXYLESTERASE NP : 5 hits 2r11_o01 naa= 3 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 1 3 # 1 C 130 SER A 60 SER.? 16.93 O2 GOL A1148 C 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 C 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -2.19 64.27 51.12 -3.34 62.10 50.60 13.07 12.22 50.34 14.07 14.38 49.84 coo -11.14 61.91 46.89 -9.88 60.30 48.76 16.15 9.89 40.11 15.07 9.53 42.65 coo -7.71 55.92 42.70 -7.18 57.60 44.85 16.78 3.97 38.41 17.89 1.85 36.97 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 2 3 # 2 C 130 SER A 107 SER~? 9.91 O2 GOL A1148 C 166 PHE A 42 PHE~? 13.86 O2 GOL A1148 C 182 PHE A 97 PHE~? 12.37 O3 AGOL A1147 coo -2.19 64.27 51.12 -3.34 62.10 50.60 3.37 4.04 45.55 4.05 2.30 47.09 coo -11.14 61.91 46.89 -9.88 60.30 48.76 7.20 3.94 37.34 6.03 3.85 34.80 coo -7.71 55.92 42.70 -7.18 57.60 44.85 4.68 -2.71 36.32 5.13 -0.43 34.81 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 3 3 # 3 C 130 SER A 108 SER~? 12.49 O2 GOL A1148 C 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 C 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -2.19 64.27 51.12 -3.34 62.10 50.60 4.99 6.08 42.77 6.34 6.55 40.80 coo -11.14 61.91 46.89 -9.88 60.30 48.76 16.15 9.89 40.11 15.07 9.53 42.65 coo -7.71 55.92 42.70 -7.18 57.60 44.85 16.78 3.97 38.41 17.89 1.85 36.97 2r11_o02 source 2R11 CARBOXYLESTERASE NP : 3 hits 2r11_o02 naa= 3 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 1 3 # 1 D 130 SER A 60 SER.? 16.93 O2 GOL A1148 D 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 D 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -32.42 55.27 46.18 -30.51 54.94 47.67 13.07 12.22 50.34 14.07 14.38 49.84 coo -23.62 58.20 50.84 -23.76 56.14 48.96 16.15 9.89 40.11 15.07 9.53 42.65 coo -23.08 51.44 54.96 -24.43 52.71 52.88 16.78 3.97 38.41 17.89 1.85 36.97 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 2 3 # 2 D 130 SER A 92 SER~? 13.14 O2 SO4 A1146 D 166 PHE A 97 PHE~? 12.37 O3 AGOL A1147 D 182 PHE A 42 PHE~? 13.86 O2 GOL A1148 coo -32.42 55.27 46.18 -30.51 54.94 47.67 -4.00 -6.25 34.54 -3.33 -8.31 35.64 coo -23.62 58.20 50.84 -23.76 56.14 48.96 4.68 -2.71 36.32 5.13 -0.43 34.81 coo -23.08 51.44 54.96 -24.43 52.71 52.88 7.20 3.94 37.34 6.03 3.85 34.80 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 3 3 # 3 D 130 SER A 107 SER~? 9.91 O2 GOL A1148 D 166 PHE A 42 PHE~? 13.86 O2 GOL A1148 D 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -32.42 55.27 46.18 -30.51 54.94 47.67 3.37 4.04 45.55 4.05 2.30 47.09 coo -23.62 58.20 50.84 -23.76 56.14 48.96 7.20 3.94 37.34 6.03 3.85 34.80 coo -23.08 51.44 54.96 -24.43 52.71 52.88 16.78 3.97 38.41 17.89 1.85 36.97 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 4 3 # 4 D 130 SER A 107 SER~? 9.91 O2 GOL A1148 D 166 PHE A 42 PHE~? 13.86 O2 GOL A1148 D 182 PHE A 97 PHE~? 12.37 O3 AGOL A1147 coo -32.42 55.27 46.18 -30.51 54.94 47.67 3.37 4.04 45.55 4.05 2.30 47.09 coo -23.62 58.20 50.84 -23.76 56.14 48.96 7.20 3.94 37.34 6.03 3.85 34.80 coo -23.08 51.44 54.96 -24.43 52.71 52.88 4.68 -2.71 36.32 5.13 -0.43 34.81 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 5 3 # 5 D 130 SER A 108 SER~? 12.49 O2 GOL A1148 D 166 PHE A 13 PHE~? 13.41 O2 GOL A1148 D 182 PHE A 40 PHE~? 11.31 O3 GOL A1148 coo -32.42 55.27 46.18 -30.51 54.94 47.67 4.99 6.08 42.77 6.34 6.55 40.80 coo -23.62 58.20 50.84 -23.76 56.14 48.96 16.15 9.89 40.11 15.07 9.53 42.65 coo -23.08 51.44 54.96 -24.43 52.71 52.88 16.78 3.97 38.41 17.89 1.85 36.97 2r11_o03 source 2R11 CARBOXYLESTERASE NP : 5 hits 2r11_o03 naa= 3 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 72 ASP.? 25.04 C1 GOL A1147 A 86 HIS A 71 HIS~? 22.50 O2 GOL A1148 A 250 ALA A 67 ALA~? 21.79 O2 GOL A1148 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 13.54 20.21 31.37 12.47 20.57 29.56 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 15.28 17.18 36.03 17.14 16.78 35.14 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 11.54 19.14 41.93 12.74 19.20 42.85 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP A 121 ASP~? 13.01 O3 SO4 A1146 A 86 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 250 ALA A 118 ALA.? 18.69 O3 SO4 A1146 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 -0.83 10.88 33.15 0.71 12.12 33.87 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 4.14 13.68 32.87 3.48 14.92 34.43 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 -1.61 18.57 37.21 -0.61 19.44 36.46 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 B 49 ASP A 72 ASP.? 25.04 C1 GOL A1147 B 86 HIS A 71 HIS~? 22.50 O2 GOL A1148 B 250 ALA A 67 ALA~? 21.79 O2 GOL A1148 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 13.54 20.21 31.37 12.47 20.57 29.56 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 15.28 17.18 36.03 17.14 16.78 35.14 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 11.54 19.14 41.93 12.74 19.20 42.85 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 B 49 ASP A 121 ASP~? 13.01 O3 SO4 A1146 B 86 HIS A 79 HIS~? 16.50 O3 SO4 A1146 B 250 ALA A 118 ALA.? 18.69 O3 SO4 A1146 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 -0.83 10.88 33.15 0.71 12.12 33.87 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 4.14 13.68 32.87 3.48 14.92 34.43 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 -1.61 18.57 37.21 -0.61 19.44 36.46 2wwt_o01 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o01 naa= 3 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 C 49 ASP A 72 ASP.? 25.04 C1 GOL A1147 C 86 HIS A 71 HIS~? 22.50 O2 GOL A1148 C 250 ALA A 67 ALA~? 21.79 O2 GOL A1148 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 13.54 20.21 31.37 12.47 20.57 29.56 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 15.28 17.18 36.03 17.14 16.78 35.14 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 11.54 19.14 41.93 12.74 19.20 42.85 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 C 49 ASP A 121 ASP~? 13.01 O3 SO4 A1146 C 86 HIS A 79 HIS~? 16.50 O3 SO4 A1146 C 250 ALA A 118 ALA.? 18.69 O3 SO4 A1146 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 -0.83 10.88 33.15 0.71 12.12 33.87 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 4.14 13.68 32.87 3.48 14.92 34.43 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 -1.61 18.57 37.21 -0.61 19.44 36.46 2wwt_o02 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o02 naa= 3 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 D 49 ASP A 72 ASP.? 25.04 C1 GOL A1147 D 86 HIS A 71 HIS~? 22.50 O2 GOL A1148 D 250 ALA A 67 ALA~? 21.79 O2 GOL A1148 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 13.54 20.21 31.37 12.47 20.57 29.56 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 15.28 17.18 36.03 17.14 16.78 35.14 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 11.54 19.14 41.93 12.74 19.20 42.85 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 D 49 ASP A 121 ASP~? 13.01 O3 SO4 A1146 D 86 HIS A 79 HIS~? 16.50 O3 SO4 A1146 D 250 ALA A 118 ALA.? 18.69 O3 SO4 A1146 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 -0.83 10.88 33.15 0.71 12.12 33.87 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 4.14 13.68 32.87 3.48 14.92 34.43 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 -1.61 18.57 37.21 -0.61 19.44 36.46 2wwt_o03 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o03 naa= 3 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 E 49 ASP A 72 ASP.? 25.04 C1 GOL A1147 E 86 HIS A 71 HIS~? 22.50 O2 GOL A1148 E 250 ALA A 67 ALA~? 21.79 O2 GOL A1148 coo -36.18 24.97 18.78 -36.93 26.11 17.11 13.54 20.21 31.37 12.47 20.57 29.56 coo -36.85 29.32 15.06 -38.90 29.14 15.48 15.28 17.18 36.03 17.14 16.78 35.14 coo -44.49 29.68 13.98 -43.47 28.67 13.52 11.54 19.14 41.93 12.74 19.20 42.85 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 E 49 ASP A 121 ASP~? 13.01 O3 SO4 A1146 E 86 HIS A 79 HIS~? 16.50 O3 SO4 A1146 E 250 ALA A 118 ALA.? 18.69 O3 SO4 A1146 coo -36.18 24.97 18.78 -36.93 26.11 17.11 -0.83 10.88 33.15 0.71 12.12 33.87 coo -36.85 29.32 15.06 -38.90 29.14 15.48 4.14 13.68 32.87 3.48 14.92 34.43 coo -44.49 29.68 13.98 -43.47 28.67 13.52 -1.61 18.57 37.21 -0.61 19.44 36.46 2wwt_o04 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o04 naa= 3 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 F 49 ASP A 72 ASP.? 25.04 C1 GOL A1147 F 86 HIS A 71 HIS~? 22.50 O2 GOL A1148 F 250 ALA A 67 ALA~? 21.79 O2 GOL A1148 coo -82.12 8.55 35.60 -81.93 9.84 37.19 13.54 20.21 31.37 12.47 20.57 29.56 coo -84.21 11.81 39.90 -82.43 12.70 39.26 15.28 17.18 36.03 17.14 16.78 35.14 coo -78.49 17.13 41.31 -79.25 15.85 41.61 11.54 19.14 41.93 12.74 19.20 42.85 2wwt_o05 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 1 hits 2wwt_o05 naa= 3 ULMN 3 3b21_o00 SHIGELLA FLEXNERI EFFECTOR OSPI user 1 3 # 1 A 62 CYH A 81 CYH~? 12.40 C1 GOL A1147 A 145 HIS A 79 HIS~? 16.50 O3 SO4 A1146 A 160 ASP A 121 ASP~? 13.01 O3 SO4 A1146 coo 9.35 16.69 -4.00 10.08 14.08 -3.37 6.31 6.18 31.19 9.06 5.87 31.56 coo 12.85 24.01 -5.47 14.14 22.37 -5.23 4.14 13.68 32.87 3.48 14.92 34.43 coo 18.70 21.56 -2.53 17.15 21.34 -3.98 -0.83 10.88 33.15 0.71 12.12 33.87 3b21_o00 source 3B21 SHIGELLA FLEXNERI EFFECTOR OSPI : 1 hits 3b21_o00 naa= 3 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 1 3 # 1 H 28 VAL A 25 VAL~? 8.40 C1 GOL A1147 H 117 LYS A 33 LYS.? 8.85 O3 GOL A1148 H 150 CYH A 81 CYH~? 12.40 C1 GOL A1147 coo 45.82 27.58 23.40 45.30 28.87 21.66 10.48 2.73 26.79 10.64 4.69 25.78 coo 38.01 32.08 28.20 39.46 29.85 23.57 8.51 -4.81 32.23 11.26 -4.33 37.14 coo 41.19 29.62 18.76 39.21 28.51 20.32 6.31 6.18 31.19 9.06 5.87 31.56 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 2 3 # 2 H 28 VAL A 41 VAL~? 12.88 O1 GOL A1147 H 117 LYS A 33 LYS.? 8.85 O3 GOL A1148 H 150 CYH A 81 CYH~? 12.40 C1 GOL A1147 coo 45.82 27.58 23.40 45.30 28.87 21.66 11.95 5.02 36.64 11.89 3.82 34.78 coo 38.01 32.08 28.20 39.46 29.85 23.57 8.51 -4.81 32.23 11.26 -4.33 37.14 coo 41.19 29.62 18.76 39.21 28.51 20.32 6.31 6.18 31.19 9.06 5.87 31.56 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 3 3 # 3 H 28 VAL A 85 VAL~? 9.71 O4 SO4 A1146 H 117 LYS A 33 LYS.? 8.85 O3 GOL A1148 H 150 CYH A 81 CYH~? 12.40 C1 GOL A1147 coo 45.82 27.58 23.40 45.30 28.87 21.66 1.32 2.11 30.91 2.02 1.51 32.92 coo 38.01 32.08 28.20 39.46 29.85 23.57 8.51 -4.81 32.23 11.26 -4.33 37.14 coo 41.19 29.62 18.76 39.21 28.51 20.32 6.31 6.18 31.19 9.06 5.87 31.56 3uao_o07 source 3UAO PUTATIVE ISOCHORISMATASE : 3 hits 3uao_o07 naa= 3 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 1 3 # 1 A 966 SER A 92 SER~? 13.14 O2 SO4 A1146 A 967 ARG A 91 ARG.? 9.03 O3 AGOL A1147 A 975 TYR A 129 TYR~? 7.58 O2 SO4 A1146 coo 82.02 40.88 31.11 79.88 41.56 30.18 -4.00 -6.25 34.54 -3.33 -8.31 35.64 coo 78.94 44.79 33.75 77.86 47.56 32.82 -0.38 -7.27 28.98 1.86 -8.15 27.08 coo 83.57 40.86 25.45 83.15 43.18 26.91 -3.64 -0.29 35.50 -3.07 -0.43 32.77 4dqk_o00 source 4DQK BIFUNCTIONAL P-450/NADPH-P450 REDUCTASE : 1 hits 4dqk_o00 naa= 3