*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1di1_c00 ARISTOLOCHENE SYNTHASE user 1 4 # 1 A 92 TYR A 39 TYR~? 14.11 O2 GOL B 3 A 112 PHE A 33 PHE~? 14.31 O1 GOL A 2 A 178 PHE A 31 PHE~? 12.84 O1 GOL A 2 A 333 TRP A 41 TRP~? 22.51 O2 GOL B 3 coo 36.26 31.30 22.39 35.67 33.02 24.49 -10.75 36.73 1.72 -12.98 38.41 1.98 coo 45.52 35.08 26.96 42.72 35.07 26.70 -5.66 26.13 3.21 -4.77 27.01 5.68 coo 43.67 42.67 22.02 43.98 41.21 24.38 -5.53 27.36 -6.14 -5.42 29.80 -7.53 coo 37.80 27.73 29.78 38.27 31.62 30.15 -2.93 36.21 7.51 -0.60 33.79 5.48 1di1_c00 source 1di1 ARISTOLOCHENE SYNTHASE : 1 hits 1di1_c00 naa= 4 ULMN 4 1di1_c01 ARISTOLOCHENE SYNTHASE user 1 4 # 1 B 92 TYR A 39 TYR~? 14.11 O2 GOL B 3 B 112 PHE A 33 PHE~? 14.31 O1 GOL A 2 B 178 PHE A 31 PHE~? 12.84 O1 GOL A 2 B 333 TRP A 41 TRP~? 22.51 O2 GOL B 3 coo 99.56 54.98 23.15 101.17 54.32 25.32 -10.75 36.73 1.72 -12.98 38.41 1.98 coo 95.53 46.26 28.54 97.54 48.18 28.09 -5.66 26.13 3.21 -4.77 27.01 5.68 coo 102.10 41.65 23.98 100.86 42.71 26.26 -5.53 27.36 -6.14 -5.42 29.80 -7.53 coo 96.01 57.16 30.39 98.35 54.06 31.01 -2.93 36.21 7.51 -0.60 33.79 5.48 1di1_c01 source 1di1 ARISTOLOCHENE SYNTHASE : 1 hits 1di1_c01 naa= 4 ULMN 4 1m53_c04 ISOMALTULOSE SYNTHASE user 1 4 # 1 A 241 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 295 GLU B 86 GLU~? 9.00 O1 GOL B 4 A 297 PHE B 83 PHE~? 7.58 O1 GOL B 4 A 369 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 11.74 38.14 80.19 10.63 36.40 80.65 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 16.11 33.72 80.99 14.10 33.54 81.63 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 14.66 28.57 79.93 13.93 26.21 81.24 -30.58 15.06 16.28 -29.58 17.16 17.80 coo 12.19 31.08 87.29 11.13 32.66 86.38 -34.62 8.62 14.62 -34.31 8.46 12.53 1m53_c04 source 1m53 ISOMALTULOSE SYNTHASE : 1 hits 1m53_c04 naa= 4 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 14 GLU~? -24.52 O3 GOL A 2s A 60 ASP A 50 ASP~? 20.38 O1 GOL B 3 A 175 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 46.10 28.27 19.27 45.48 26.99 20.84 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 56.42 28.06 12.93 55.01 27.92 14.50 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 45.02 22.04 15.38 46.16 24.00 13.76 2.18 28.14 10.75 1.63 29.43 8.35 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 2 3 # 2 A 49 GLU A 14 GLU~? -24.52 O3 GOL A 2s A 60 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 175 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 46.10 28.27 19.27 45.48 26.99 20.84 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 56.42 28.06 12.93 55.01 27.92 14.50 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 45.02 22.04 15.38 46.16 24.00 13.76 2.18 28.14 10.75 1.63 29.43 8.35 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 3 3 # 3 A 49 GLU A 57 GLU~? 16.18 C3 GOL B 4 A 60 ASP A 50 ASP~? 20.38 O1 GOL B 3 A 175 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 46.10 28.27 19.27 45.48 26.99 20.84 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 56.42 28.06 12.93 55.01 27.92 14.50 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 45.02 22.04 15.38 46.16 24.00 13.76 -18.76 26.04 16.25 -16.06 26.60 15.60 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 4 3 # 4 A 49 GLU B 57 GLU~? -4.12 O3 GOL B 4s A 60 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 175 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 46.10 28.27 19.27 45.48 26.99 20.84 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 56.42 28.06 12.93 55.01 27.92 14.50 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 45.02 22.04 15.38 46.16 24.00 13.76 -18.76 26.04 16.25 -16.06 26.60 15.60 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 4 hits 1a50_c03 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 28 ASP~? -5.64 O1 GOL A 2s 214 ASP B 60 ASP~? 9.78 O3 GOL B 4 289 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo -0.62 65.95 29.97 0.31 67.47 31.05 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 26.86 59.76 46.36 25.42 58.23 45.92 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 9.42 68.07 30.27 7.35 68.27 30.10 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 74 ASP~? -7.66 O2 GOL A 2s 214 ASP B 74 ASP~? -3.22 O1 SO4 B 1s 289 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo -0.62 65.95 29.97 0.31 67.47 31.05 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 26.86 59.76 46.36 25.42 58.23 45.92 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 9.42 68.07 30.27 7.35 68.27 30.10 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP B 79 ASP~? 15.24 O1 GOL B 4 214 ASP A 79 ASP~? 10.37 O2 GOL B 3 289 ASP B 85 ASP~? 11.13 O1 GOL B 4 coo -0.62 65.95 29.97 0.31 67.47 31.05 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 9.42 68.07 30.27 7.35 68.27 30.10 -32.24 14.59 8.46 -32.94 14.97 6.62 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 3 hits 1amy_c01 naa= 3 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP B 85 ASP~? 11.13 O1 GOL B 4 204 GLU B 86 GLU~? 9.00 O1 GOL B 4 289 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo -0.62 65.95 29.97 0.31 67.47 31.05 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 4.34 62.44 32.05 4.22 64.48 32.53 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 9.42 68.07 30.27 7.35 68.27 30.10 -34.62 8.62 14.62 -34.31 8.46 12.53 1amy_c05 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 1 hits 1amy_c05 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 74 ASP~? -7.66 O2 GOL A 2s 227 GLU A 63 GLU~? 12.00 O3 GOL A 2 289 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo -0.62 65.95 29.97 0.31 67.47 31.05 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 3.96 55.76 41.24 4.83 57.69 41.17 -6.94 17.09 6.76 -5.68 16.32 8.28 coo 9.42 68.07 30.27 7.35 68.27 30.10 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP B 50 ASP~? -2.86 O3 GOL B 3s 227 GLU A 57 GLU~? 16.18 C3 GOL B 4 289 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo -0.62 65.95 29.97 0.31 67.47 31.05 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 3.96 55.76 41.24 4.83 57.69 41.17 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 9.42 68.07 30.27 7.35 68.27 30.10 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP B 85 ASP~? 11.13 O1 GOL B 4 227 GLU B 57 GLU~? -4.12 O3 GOL B 4s 289 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo -0.62 65.95 29.97 0.31 67.47 31.05 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 3.96 55.76 41.24 4.83 57.69 41.17 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 9.42 68.07 30.27 7.35 68.27 30.10 -34.62 8.62 14.62 -34.31 8.46 12.53 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 3 hits 1amy_c06 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 33 PHE~? 14.31 O1 GOL A 2 A 223 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 265 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 39.74 52.86 65.74 41.15 55.14 66.52 -5.66 26.13 3.21 -4.77 27.01 5.68 coo 30.70 47.50 67.53 29.83 49.47 67.39 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 19.99 54.53 64.11 20.55 58.78 68.33 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE A 62 PHE~? 10.05 O1 GOL A 2 A 223 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 265 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 39.74 52.86 65.74 41.15 55.14 66.52 -10.46 22.36 3.39 -11.36 24.71 2.13 coo 30.70 47.50 67.53 29.83 49.47 67.39 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 19.99 54.53 64.11 20.55 58.78 68.33 -29.46 26.70 6.25 -26.96 24.00 2.30 1ax4_c04 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 33 PHE~? 14.31 O1 GOL A 2 B 223 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 265 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 7.48 54.94 99.62 7.67 52.27 100.42 -5.66 26.13 3.21 -4.77 27.01 5.68 coo 10.43 61.66 91.81 9.80 60.04 90.61 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 5.43 58.06 80.08 8.57 53.00 79.37 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE A 62 PHE~? 10.05 O1 GOL A 2 B 223 ASP A 74 ASP~? -7.66 O2 GOL A 2s B 265 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 7.48 54.94 99.62 7.67 52.27 100.42 -10.46 22.36 3.39 -11.36 24.71 2.13 coo 10.43 61.66 91.81 9.80 60.04 90.61 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 5.43 58.06 80.08 8.57 53.00 79.37 -29.46 26.70 6.25 -26.96 24.00 2.30 1ax4_c05 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 33 PHE~? 14.31 O1 GOL A 2 C 223 ASP A 60 ASP~? 16.34 O3 GOL A 2 C 265 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo -6.55 73.45 23.60 -6.77 71.48 21.66 -5.66 26.13 3.21 -4.77 27.01 5.68 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -10.35 19.90 11.39 -8.96 19.35 12.87 coo -4.44 67.20 42.32 -7.50 62.41 40.49 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE A 62 PHE~? 10.05 O1 GOL A 2 C 223 ASP A 74 ASP~? -7.66 O2 GOL A 2s C 265 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo -6.55 73.45 23.60 -6.77 71.48 21.66 -10.46 22.36 3.39 -11.36 24.71 2.13 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo -4.44 67.20 42.32 -7.50 62.41 40.49 -29.46 26.70 6.25 -26.96 24.00 2.30 1ax4_c06 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 33 PHE~? 14.31 O1 GOL A 2 D 223 ASP A 60 ASP~? 16.34 O3 GOL A 2 D 265 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo -38.60 55.38 52.70 -40.06 57.72 53.04 -5.66 26.13 3.21 -4.77 27.01 5.68 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -10.35 19.90 11.39 -8.96 19.35 12.87 coo -18.87 56.53 54.79 -19.47 62.22 53.03 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE A 62 PHE~? 10.05 O1 GOL A 2 D 223 ASP A 74 ASP~? -7.66 O2 GOL A 2s D 265 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo -38.60 55.38 52.70 -40.06 57.72 53.04 -10.46 22.36 3.39 -11.36 24.71 2.13 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo -18.87 56.53 54.79 -19.47 62.22 53.03 -29.46 26.70 6.25 -26.96 24.00 2.30 1ax4_c07 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c07 naa= 3 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 A 109 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 182 GLU A 78 GLU.? 14.22 O2 GOL B 3 A 286 ASN B 47 ASN~? -3.34 C2 GOL B 3s coo 26.03 44.66 108.90 25.67 42.61 108.82 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 18.06 44.02 105.38 18.08 45.37 107.03 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo 25.47 38.28 112.06 27.26 39.30 111.54 -22.17 24.60 2.06 -23.18 26.07 3.21 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 74 ASP~? -7.66 O2 GOL A 2s B 182 GLU A 68 GLU~? 10.31 O3 GOL A 2 B 286 ASN B 47 ASN~? -3.34 C2 GOL B 3s coo 13.82 69.26 132.27 11.87 70.14 132.51 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 8.74 63.05 136.42 9.87 62.19 134.79 -16.23 12.26 4.49 -17.05 10.50 5.25 coo 8.26 72.60 129.22 10.14 73.45 129.80 -22.17 24.60 2.06 -23.18 26.07 3.21 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 # 2 B 109 ASP A 74 ASP~? -7.66 O2 GOL A 2s B 182 GLU A 78 GLU.? 14.22 O2 GOL B 3 B 286 ASN B 47 ASN~? -3.34 C2 GOL B 3s coo 13.82 69.26 132.27 11.87 70.14 132.51 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 8.74 63.05 136.42 9.87 62.19 134.79 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo 8.26 72.60 129.22 10.14 73.45 129.80 -22.17 24.60 2.06 -23.18 26.07 3.21 1b57_c01 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 2 hits 1b57_c01 naa= 3 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 A 145 TYR A 56 TYR~? 21.37 C3 GOL A 2 A 230 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 273 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 9.23 21.44 106.88 10.18 19.34 105.31 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 1.45 22.80 104.16 2.58 21.02 104.01 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 2.97 11.64 107.87 6.59 15.13 107.03 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 A 145 TYR B 56 TYR~? 10.55 O3 GOL B 4 A 230 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 273 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 9.23 21.44 106.88 10.18 19.34 105.31 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 1.45 22.80 104.16 2.58 21.02 104.01 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 2.97 11.64 107.87 6.59 15.13 107.03 -9.77 24.33 22.44 -10.89 19.77 26.71 1b8g_c04 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 2 hits 1b8g_c04 naa= 3 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 B 145 TYR A 56 TYR~? 21.37 C3 GOL A 2 B 230 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 273 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 11.81 13.41 73.03 10.00 13.03 75.12 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 19.17 11.01 76.14 17.26 10.42 76.77 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 11.10 2.31 76.60 10.24 7.24 75.62 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 B 145 TYR B 56 TYR~? 10.55 O3 GOL B 4 B 230 ASP B 60 ASP~? 9.78 O3 GOL B 4 B 273 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 11.81 13.41 73.03 10.00 13.03 75.12 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 19.17 11.01 76.14 17.26 10.42 76.77 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 11.10 2.31 76.60 10.24 7.24 75.62 -9.77 24.33 22.44 -10.89 19.77 26.71 1b8g_c05 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 2 hits 1b8g_c05 naa= 3 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 1 3 # 1 A 88 PHE A 62 PHE~? 10.05 O1 GOL A 2 A 159 ASP A 28 ASP~? -5.64 O1 GOL A 2s A 188 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 13.91 34.58 14.67 12.95 36.00 12.47 -10.46 22.36 3.39 -11.36 24.71 2.13 coo 20.97 28.40 16.26 20.19 30.15 15.34 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 22.55 41.65 15.60 18.92 37.20 14.63 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 2 3 # 2 A 88 PHE A 83 PHE~? 7.77 O2 GOL B 3 A 159 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 188 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 13.91 34.58 14.67 12.95 36.00 12.47 -16.08 29.46 2.61 -15.52 27.45 4.47 coo 20.97 28.40 16.26 20.19 30.15 15.34 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 22.55 41.65 15.60 18.92 37.20 14.63 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 3 3 # 3 A 88 PHE A 83 PHE~? 7.77 O2 GOL B 3 A 159 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 188 LYS A 34 LYS~? 16.07 O1 GOL A 2 coo 13.91 34.58 14.67 12.95 36.00 12.47 -16.08 29.46 2.61 -15.52 27.45 4.47 coo 20.97 28.40 16.26 20.19 30.15 15.34 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 22.55 41.65 15.60 18.92 37.20 14.63 -4.31 29.33 -0.01 -0.74 29.76 -4.84 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 4 3 # 4 A 88 PHE A 83 PHE~? 7.77 O2 GOL B 3 A 159 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 188 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 13.91 34.58 14.67 12.95 36.00 12.47 -16.08 29.46 2.61 -15.52 27.45 4.47 coo 20.97 28.40 16.26 20.19 30.15 15.34 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 22.55 41.65 15.60 18.92 37.20 14.63 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 4 hits 1b9h_c02 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 50 ASP~? 20.38 O1 GOL B 3 16 HIS A 53 HIS~? 22.15 O3 GOL B 4 67 GLY A 65 GLY~? 6.84 C3 GOL A 2 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -8.90 35.05 16.33 -9.12 35.63 18.37 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -6.79 29.31 17.48 -5.37 29.37 19.01 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -14.11 16.35 3.28 -13.40 15.97 3.38 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP B 50 ASP~? -2.86 O3 GOL B 3s 16 HIS B 53 HIS~? 4.97 C1 GOL B 3 67 GLY B 65 GLY~? 8.46 O1 SO4 B 1 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -24.34 23.91 6.60 -25.45 25.08 5.29 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -25.88 17.05 28.32 -25.11 17.28 28.54 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 3 3 # 3 14 ASP B 50 ASP~? -2.86 O3 GOL B 3s 16 HIS B 53 HIS~? 4.97 C1 GOL B 3 67 GLY B 77 GLY~? 11.15 O1 SO4 B 1 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -24.34 23.91 6.60 -25.45 25.08 5.29 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -33.80 11.09 20.38 -32.97 10.98 20.23 1be1_c02 source 1be1 GLUTAMATE MUTASE : 3 hits 1be1_c02 naa= 3 ULMN 3 1bf2_c00 ISOAMYLASE user 1 3 # 1 375 ASP B 85 ASP~? 11.13 O1 GOL B 4 435 GLU B 86 GLU~? 9.00 O1 GOL B 4 510 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 88.62 69.90 41.16 89.05 70.67 43.04 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 89.52 76.11 40.17 89.01 75.16 41.97 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 84.89 77.60 46.67 85.63 75.79 46.03 -34.62 8.62 14.62 -34.31 8.46 12.53 1bf2_c00 source 1bf2 ISOAMYLASE : 1 hits 1bf2_c00 naa= 3 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 A 82 HIS A 53 HIS~? 22.15 O3 GOL B 4 A 168 ARG A 21 ARG~? 15.66 O3 GOL A 2 A 187 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 62.47 12.00 59.65 61.76 10.14 60.31 -6.79 29.31 17.48 -5.37 29.37 19.01 coo 55.10 8.37 73.00 55.48 9.59 70.20 -2.39 18.19 10.15 -5.10 18.35 11.53 coo 66.76 10.09 66.23 61.80 8.06 65.82 -9.77 24.33 22.44 -10.89 19.77 26.71 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 83 PHE~? 7.77 O2 GOL B 3 A 205 ASP A 28 ASP~? -5.64 O1 GOL A 2s A 236 LYS A 34 LYS~? 16.07 O1 GOL A 2 coo 4.14 2.10 36.34 6.69 3.08 36.92 -16.08 29.46 2.61 -15.52 27.45 4.47 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 -4.31 29.33 -0.01 -0.74 29.76 -4.84 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 1 hits 1bs0_c01 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 55 GLN~? 19.25 O2 GOL B 3 A 91 LEU A 52 LEU~? 22.97 O2 GOL B 3 A 133 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 43.58 43.67 66.73 42.32 42.78 68.15 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 38.58 45.09 70.44 38.28 45.21 72.59 -3.59 30.93 13.59 -1.64 31.39 12.76 coo 44.05 36.87 70.65 43.15 38.64 69.97 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 55 GLN~? 19.25 O2 GOL B 3 A 91 LEU A 87 LEU~? 10.16 O2 GOL B 3 A 133 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 43.58 43.67 66.73 42.32 42.78 68.15 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 38.58 45.09 70.44 38.28 45.21 72.59 -14.42 31.83 7.41 -13.85 29.77 7.64 coo 44.05 36.87 70.65 43.15 38.64 69.97 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN B 55 GLN~? 11.94 C1 GOL B 4 A 91 LEU B 52 LEU~? 9.29 C1 GOL B 3 A 133 GLU B 57 GLU~? -4.12 O3 GOL B 4s coo 43.58 43.67 66.73 42.32 42.78 68.15 -19.21 19.98 13.18 -17.25 19.78 12.27 coo 38.58 45.09 70.44 38.28 45.21 72.59 -18.30 25.52 10.44 -16.19 25.46 9.84 coo 44.05 36.87 70.65 43.15 38.64 69.97 -25.78 25.15 16.73 -26.80 26.19 18.23 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 55 GLN~? 19.25 O2 GOL B 3 B 591 LEU A 52 LEU~? 22.97 O2 GOL B 3 B 633 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 88.06 44.34 57.19 89.06 45.53 55.74 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 86.70 48.66 52.61 87.15 48.69 50.51 -3.59 30.93 13.59 -1.64 31.39 12.76 coo 95.42 44.52 54.43 93.46 45.31 54.70 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN A 55 GLN~? 19.25 O2 GOL B 3 B 591 LEU A 87 LEU~? 10.16 O2 GOL B 3 B 633 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 88.06 44.34 57.19 89.06 45.53 55.74 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 86.70 48.66 52.61 87.15 48.69 50.51 -14.42 31.83 7.41 -13.85 29.77 7.64 coo 95.42 44.52 54.43 93.46 45.31 54.70 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 3 3 # 3 B 550 GLN B 55 GLN~? 11.94 C1 GOL B 4 B 591 LEU B 52 LEU~? 9.29 C1 GOL B 3 B 633 GLU B 57 GLU~? -4.12 O3 GOL B 4s coo 88.06 44.34 57.19 89.06 45.53 55.74 -19.21 19.98 13.18 -17.25 19.78 12.27 coo 86.70 48.66 52.61 87.15 48.69 50.51 -18.30 25.52 10.44 -16.19 25.46 9.84 coo 95.42 44.52 54.43 93.46 45.31 54.70 -25.78 25.15 16.73 -26.80 26.19 18.23 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 55 GLN~? 19.25 O2 GOL B 3 C1091 LEU A 52 LEU~? 22.97 O2 GOL B 3 C1133 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 68.29 34.44 43.03 66.67 34.74 44.37 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 65.83 38.95 47.05 65.46 38.90 49.20 -3.59 30.93 13.59 -1.64 31.39 12.76 coo 63.14 29.39 46.25 63.84 31.31 45.74 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN A 55 GLN~? 19.25 O2 GOL B 3 C1091 LEU A 87 LEU~? 10.16 O2 GOL B 3 C1133 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 68.29 34.44 43.03 66.67 34.74 44.37 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 65.83 38.95 47.05 65.46 38.90 49.20 -14.42 31.83 7.41 -13.85 29.77 7.64 coo 63.14 29.39 46.25 63.84 31.31 45.74 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 3 3 # 3 C1050 GLN B 55 GLN~? 11.94 C1 GOL B 4 C1091 LEU B 52 LEU~? 9.29 C1 GOL B 3 C1133 GLU B 57 GLU~? -4.12 O3 GOL B 4s coo 68.29 34.44 43.03 66.67 34.74 44.37 -19.21 19.98 13.18 -17.25 19.78 12.27 coo 65.83 38.95 47.05 65.46 38.90 49.20 -18.30 25.52 10.44 -16.19 25.46 9.84 coo 63.14 29.39 46.25 63.84 31.31 45.74 -25.78 25.15 16.73 -26.80 26.19 18.23 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 55 GLN~? 19.25 O2 GOL B 3 A 91 LEU A 52 LEU~? 22.97 O2 GOL B 3 A 133 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 38.23 53.34 67.59 38.84 53.87 69.56 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 35.40 53.22 73.30 35.37 54.87 74.74 -3.59 30.93 13.59 -1.64 31.39 12.76 coo 45.08 56.04 70.60 43.15 55.19 70.77 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 55 GLN~? 19.25 O2 GOL B 3 A 91 LEU A 87 LEU~? 10.16 O2 GOL B 3 A 133 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 38.23 53.34 67.59 38.84 53.87 69.56 -6.58 30.17 8.61 -4.83 31.30 8.22 coo 35.40 53.22 73.30 35.37 54.87 74.74 -14.42 31.83 7.41 -13.85 29.77 7.64 coo 45.08 56.04 70.60 43.15 55.19 70.77 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN B 55 GLN~? 11.94 C1 GOL B 4 A 91 LEU B 52 LEU~? 9.29 C1 GOL B 3 A 133 GLU B 57 GLU~? -4.12 O3 GOL B 4s coo 38.23 53.34 67.59 38.84 53.87 69.56 -19.21 19.98 13.18 -17.25 19.78 12.27 coo 35.40 53.22 73.30 35.37 54.87 74.74 -18.30 25.52 10.44 -16.19 25.46 9.84 coo 45.08 56.04 70.60 43.15 55.19 70.77 -25.78 25.15 16.73 -26.80 26.19 18.23 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 3 hits 1bsj_c00 naa= 3 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 # 1 A 325 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 354 GLU A 78 GLU.? 14.22 O2 GOL B 3 A 421 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 31.05 49.37 64.51 31.97 51.11 63.85 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 29.07 50.42 58.36 29.02 52.18 59.49 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo 30.82 59.76 58.47 31.12 59.02 60.40 -18.93 20.14 -2.22 -19.22 19.03 -4.07 1bvz_c08 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c08 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP A 79 ASP~? 10.37 O2 GOL B 3 B 354 GLU A 78 GLU.? 14.22 O2 GOL B 3 B 421 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 25.90 8.19 53.87 25.36 6.97 52.29 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 27.87 10.66 47.95 27.82 8.60 48.27 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo 26.02 1.87 43.38 25.90 1.97 45.49 -18.93 20.14 -2.22 -19.22 19.03 -4.07 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c09 naa= 3 ULMN 3 1bwl_c01 NADPH DEHYDROGENASE 1 user 1 3 # 1 191 ASN A 90 ASN~? 6.78 O1 GOL B 3 194 HIS B 53 HIS~? 4.97 C1 GOL B 3 196 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 40.94 71.26 25.74 40.29 70.59 23.82 -18.60 32.80 11.91 -20.33 33.24 10.71 coo 38.86 67.47 19.31 37.78 65.73 19.79 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 41.10 73.64 20.13 38.52 73.39 19.02 -18.76 26.04 16.25 -16.06 26.60 15.60 1bwl_c01 source 1bwl NADPH DEHYDROGENASE 1 : 1 hits 1bwl_c01 naa= 3 ULMN 3 1c82_c00 HYALURONATE LYASE user 1 3 # 1 A 349 ASN A 90 ASN~? 6.78 O1 GOL B 3 A 399 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 408 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 11.39 -18.14 26.77 11.56 -16.76 28.37 -18.60 32.80 11.91 -20.33 33.24 10.71 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 -18.76 26.04 16.25 -16.06 26.60 15.60 1c82_c00 source 1c82 HYALURONATE LYASE : 1 hits 1c82_c00 naa= 3 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 # 1 A 14 ASP A 50 ASP~? 20.38 O1 GOL B 3 A 16 HIS A 53 HIS~? 22.15 O3 GOL B 4 A 67 GLY A 46 GLY.? 20.95 O1 GOL B 3 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 -6.79 29.31 17.48 -5.37 29.37 19.01 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 -8.63 41.09 14.90 -8.01 41.16 14.41 1cb7_c06 source 1cb7 GLUTAMATE MUTASE : 1 hits 1cb7_c06 naa= 3 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 # 1 C 14 ASP A 50 ASP~? 20.38 O1 GOL B 3 C 16 HIS A 53 HIS~? 22.15 O3 GOL B 4 C 67 GLY A 46 GLY.? 20.95 O1 GOL B 3 coo 10.04 44.27 88.44 9.47 42.32 89.03 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 6.38 39.80 88.71 6.88 38.89 86.87 -6.79 29.31 17.48 -5.37 29.37 19.01 coo 17.63 42.50 89.25 18.11 42.29 88.64 -8.63 41.09 14.90 -8.01 41.16 14.41 1cb7_c07 source 1cb7 GLUTAMATE MUTASE : 1 hits 1cb7_c07 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 74 ASP~? -7.66 O2 GOL A 2s 264 GLU A 57 GLU~? 16.18 C3 GOL B 4 328 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 45.62 80.42 43.69 45.65 82.01 45.07 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 59.69 92.71 39.85 58.53 92.03 41.47 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 45.39 90.72 40.63 45.07 89.14 41.90 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP B 50 ASP~? -2.86 O3 GOL B 3s 264 GLU A 63 GLU~? 12.00 O3 GOL A 2 328 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 45.62 80.42 43.69 45.65 82.01 45.07 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 59.69 92.71 39.85 58.53 92.03 41.47 -6.94 17.09 6.76 -5.68 16.32 8.28 coo 45.39 90.72 40.63 45.07 89.14 41.90 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP B 79 ASP~? 15.24 O1 GOL B 4 264 GLU B 57 GLU~? -4.12 O3 GOL B 4s 328 ASP B 85 ASP~? 11.13 O1 GOL B 4 coo 45.62 80.42 43.69 45.65 82.01 45.07 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 59.69 92.71 39.85 58.53 92.03 41.47 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 45.39 90.72 40.63 45.07 89.14 41.90 -32.24 14.59 8.46 -32.94 14.97 6.62 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 3 hits 1cdg_c00 naa= 3 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 A 198 GLY B 46 GLY.? 6.70 O3 GOL B 3 A 228 SER B 44 SER~? 10.16 O3 GOL B 3 A 549 ASP B 85 ASP~? 11.13 O1 GOL B 4 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 -24.88 21.02 3.88 -24.62 20.77 3.13 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -27.03 16.17 3.37 -25.38 17.46 4.61 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -32.24 14.59 8.46 -32.94 14.97 6.62 1cjy_c00 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 1 hits 1cjy_c00 naa= 3 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 B1198 GLY B 46 GLY.? 6.70 O3 GOL B 3 B1228 SER B 44 SER~? 10.16 O3 GOL B 3 B1549 ASP B 85 ASP~? 11.13 O1 GOL B 4 coo 126.34 72.75 125.66 125.95 73.27 126.11 -24.88 21.02 3.88 -24.62 20.77 3.13 coo 131.65 74.68 129.41 130.31 72.73 128.82 -27.03 16.17 3.37 -25.38 17.46 4.61 coo 134.72 69.43 130.42 133.03 70.65 130.08 -32.24 14.59 8.46 -32.94 14.97 6.62 1cjy_c01 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 1 hits 1cjy_c01 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 29 TYR~? -4.87 O1 GOL A 2s A 173 ASP A 28 ASP~? -5.64 O1 GOL A 2s C 48 ARG A 70 ARG.? 9.89 O2 GOL A 2s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -9.33 19.89 -0.73 -11.85 18.67 -0.31 coo 24.35 4.55 25.11 25.94 3.23 25.53 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -18.90 15.15 -0.51 -21.15 17.20 -0.06 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 70 ARG.? 9.89 O2 GOL A 2s C 101 TYR A 29 TYR~? -4.87 O1 GOL A 2s C 173 ASP A 28 ASP~? -5.64 O1 GOL A 2s coo 32.27 5.62 48.15 31.93 6.48 51.06 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 29.64 3.64 57.39 31.22 5.14 55.65 -9.33 19.89 -0.73 -11.85 18.67 -0.31 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -8.78 21.17 -6.27 -8.56 20.83 -8.37 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 70 ARG.? 9.89 O2 GOL A 2s D 101 TYR A 29 TYR~? -4.87 O1 GOL A 2s D 173 ASP A 28 ASP~? -5.64 O1 GOL A 2s coo 69.08 8.58 32.60 69.70 10.81 30.58 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 71.77 11.86 24.26 70.23 12.22 26.56 -9.33 19.89 -0.73 -11.85 18.67 -0.31 coo 71.60 6.14 19.25 70.26 6.87 20.69 -8.78 21.17 -6.27 -8.56 20.83 -8.37 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 48 ARG B 21 ARG.? 13.55 O3 GOL B 4 D 101 TYR B 15 TYR.? 18.41 O3 GOL B 4 D 173 ASP A 50 ASP~? 20.38 O1 GOL B 3 coo 69.08 8.58 32.60 69.70 10.81 30.58 -14.41 22.89 22.20 -17.07 24.46 22.16 coo 71.77 11.86 24.26 70.23 12.22 26.56 -9.10 28.01 20.14 -10.98 27.06 18.31 coo 71.60 6.14 19.25 70.26 6.87 20.69 -8.90 35.05 16.33 -9.12 35.63 18.37 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 48 ARG B 70 ARG.? -4.45 O4 SO4 B 1s D 101 TYR B 29 TYR~? 8.93 O1 SO4 B 1 D 173 ASP B 28 ASP~? 10.74 O1 SO4 B 1 coo 69.08 8.58 32.60 69.70 10.81 30.58 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 71.77 11.86 24.26 70.23 12.22 26.56 -22.35 12.75 24.72 -24.49 13.46 26.40 coo 71.60 6.14 19.25 70.26 6.87 20.69 -22.51 7.08 24.60 -22.34 5.01 25.19 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 29 TYR~? -4.87 O1 GOL A 2s B 173 ASP A 28 ASP~? -5.64 O1 GOL A 2s D 48 ARG A 70 ARG.? 9.89 O2 GOL A 2s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -9.33 19.89 -0.73 -11.85 18.67 -0.31 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -18.90 15.15 -0.51 -21.15 17.20 -0.06 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c03 naa= 3 ULMN 3 1cwy_c00 AMYLOMALTASE user 1 3 # 1 A 293 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 340 GLU B 86 GLU~? 9.00 O1 GOL B 4 A 395 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 -32.24 14.59 8.46 -32.94 14.97 6.62 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 -35.32 17.29 11.75 -36.56 18.30 10.39 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 -34.62 8.62 14.62 -34.31 8.46 12.53 1cwy_c00 source 1cwy AMYLOMALTASE : 1 hits 1cwy_c00 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 56 ILE A 75 ILE~? 9.88 C3 GOL A 2 A 82 TYR A 29 TYR~? -4.87 O1 GOL A 2s coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 -16.11 22.42 1.56 -15.37 21.65 2.55 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 -9.33 19.89 -0.73 -11.85 18.67 -0.31 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 56 ILE B 59 ILE~? 12.31 C2 GOL B 4 A 82 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 -19.30 21.00 20.44 -17.90 20.72 20.25 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 -18.76 26.04 16.25 -16.06 26.60 15.60 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 # 3 A 37 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 56 ILE A 36 ILE~? 13.49 O2 GOL B 3 A 82 TYR A 39 TYR~? 14.11 O2 GOL B 3 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 -9.43 30.44 2.60 -10.58 29.73 3.07 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 -10.75 36.73 1.72 -12.98 38.41 1.98 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 # 4 A 37 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 56 ILE B 36 ILE~? 9.88 O1 GOL B 4 A 82 TYR B 39 TYR~? 12.50 O1 GOL B 4 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 -24.28 13.90 13.77 -25.22 14.63 14.50 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 -26.88 11.91 8.14 -29.28 12.36 6.79 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 # 5 A 37 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 56 ILE B 75 ILE~? 8.90 O1 SO4 B 1 A 82 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 -29.56 15.43 23.90 -28.67 16.35 24.38 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 -22.35 12.75 24.72 -24.49 13.46 26.40 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 6 3 # 6 A 37 ASP B 79 ASP~? 15.24 O1 GOL B 4 A 56 ILE B 36 ILE~? 9.88 O1 GOL B 4 A 82 TYR B 39 TYR~? 12.50 O1 GOL B 4 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 -24.28 13.90 13.77 -25.22 14.63 14.50 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 -26.88 11.91 8.14 -29.28 12.36 6.79 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 56 ILE A 75 ILE~? 9.88 C3 GOL A 2 B 82 TYR A 29 TYR~? -4.87 O1 GOL A 2s coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 -16.11 22.42 1.56 -15.37 21.65 2.55 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 -9.33 19.89 -0.73 -11.85 18.67 -0.31 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 56 ILE B 59 ILE~? 12.31 C2 GOL B 4 B 82 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 -19.30 21.00 20.44 -17.90 20.72 20.25 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 -18.76 26.04 16.25 -16.06 26.60 15.60 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 # 3 B 37 ASP A 79 ASP~? 10.37 O2 GOL B 3 B 56 ILE A 36 ILE~? 13.49 O2 GOL B 3 B 82 TYR A 39 TYR~? 14.11 O2 GOL B 3 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 -9.43 30.44 2.60 -10.58 29.73 3.07 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 -10.75 36.73 1.72 -12.98 38.41 1.98 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 # 4 B 37 ASP B 50 ASP~? -2.86 O3 GOL B 3s B 56 ILE B 36 ILE~? 9.88 O1 GOL B 4 B 82 TYR B 39 TYR~? 12.50 O1 GOL B 4 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 -24.28 13.90 13.77 -25.22 14.63 14.50 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 -26.88 11.91 8.14 -29.28 12.36 6.79 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 5 3 # 5 B 37 ASP B 60 ASP~? 9.78 O3 GOL B 4 B 56 ILE B 75 ILE~? 8.90 O1 SO4 B 1 B 82 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 -29.56 15.43 23.90 -28.67 16.35 24.38 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 -22.35 12.75 24.72 -24.49 13.46 26.40 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 6 3 # 6 B 37 ASP B 79 ASP~? 15.24 O1 GOL B 4 B 56 ILE B 36 ILE~? 9.88 O1 GOL B 4 B 82 TYR B 39 TYR~? 12.50 O1 GOL B 4 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 -24.28 13.90 13.77 -25.22 14.63 14.50 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 -26.88 11.91 8.14 -29.28 12.36 6.79 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c01 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 200 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 229 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 1.13 77.49 40.64 0.62 75.57 39.98 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 0.84 91.24 49.01 2.91 91.61 49.23 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 10.53 97.56 43.71 9.33 93.71 47.17 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1dfo_c12 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c12 naa= 3 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 123 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 200 ASP A 79 ASP~? 10.37 O2 GOL B 3 B 229 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 9.24 94.26 88.22 8.02 94.07 89.92 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 17.54 90.31 75.01 17.17 92.01 73.80 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 22.32 101.61 71.64 17.89 98.63 71.55 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1dfo_c13 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c13 naa= 3 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 123 HIS B 53 HIS~? 4.97 C1 GOL B 3 C 200 ASP A 79 ASP~? 10.37 O2 GOL B 3 C 229 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 26.77 65.84 83.49 27.06 67.76 84.27 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 19.52 52.01 79.59 20.28 51.65 77.65 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 28.90 45.91 73.55 25.22 49.72 72.97 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1dfo_c14 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c14 naa= 3 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 123 HIS B 53 HIS~? 4.97 C1 GOL B 3 D 200 ASP A 79 ASP~? 10.37 O2 GOL B 3 D 229 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -10.90 48.74 53.41 -12.98 48.90 53.67 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 4.60 52.95 52.50 5.57 51.29 53.40 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 10.05 41.79 49.80 7.94 44.71 53.76 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c15 naa= 3 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 1 3 # 1 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 150 LYS A 35 LYS~? 14.51 O1 GOL A 2 186 ASN A 90 ASN~? 6.78 O1 GOL B 3 coo 32.88 50.55 24.33 31.89 51.78 26.65 -10.75 36.73 1.72 -12.98 38.41 1.98 coo 27.04 52.42 22.30 26.88 49.99 27.00 -7.03 31.61 -1.42 -10.99 31.33 -6.00 coo 36.98 50.30 37.29 35.85 50.29 35.50 -18.60 32.80 11.91 -20.33 33.24 10.71 1dhr_c00 source 1dhr DIHYDROPTERIDINE REDUCTASE (DHPR) (E.C.1.6.99.: 1 hits 1dhr_c00 naa= 3 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 39 TYR~? 14.11 O2 GOL B 3 A 40 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 103 ASP A 85 ASP~? 11.55 O1 GOL B 3 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 -10.75 36.73 1.72 -12.98 38.41 1.98 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 -16.43 37.33 3.51 -16.88 39.23 4.17 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR B 39 TYR~? 12.50 O1 GOL B 4 A 40 ASP B 79 ASP~? 15.24 O1 GOL B 4 A 103 ASP B 85 ASP~? 11.13 O1 GOL B 4 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 -26.88 11.91 8.14 -29.28 12.36 6.79 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 -32.24 14.59 8.46 -32.94 14.97 6.62 1e3v_c02 source 1e3v STEROID DELTA-ISOMERASE : 2 hits 1e3v_c02 naa= 3 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 39 TYR~? 14.11 O2 GOL B 3 B 40 ASP A 79 ASP~? 10.37 O2 GOL B 3 B 103 ASP A 85 ASP~? 11.55 O1 GOL B 3 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 -10.75 36.73 1.72 -12.98 38.41 1.98 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 -16.43 37.33 3.51 -16.88 39.23 4.17 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR B 39 TYR~? 12.50 O1 GOL B 4 B 40 ASP B 79 ASP~? 15.24 O1 GOL B 4 B 103 ASP B 85 ASP~? 11.13 O1 GOL B 4 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 -26.88 11.91 8.14 -29.28 12.36 6.79 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 -32.24 14.59 8.46 -32.94 14.97 6.62 1e3v_c03 source 1e3v STEROID DELTA-ISOMERASE : 2 hits 1e3v_c03 naa= 3 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 B 107 ASP A 50 ASP~? 20.38 O1 GOL B 3 B 246 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 275 HIS A 53 HIS~? 22.15 O3 GOL B 4 coo 34.84 56.77 81.62 34.95 54.74 82.03 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 43.18 49.30 68.39 44.75 49.87 69.78 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 38.73 55.10 77.62 36.80 55.01 78.46 -6.79 29.31 17.48 -5.37 29.37 19.01 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 B 107 ASP B 50 ASP~? -2.86 O3 GOL B 3s B 246 ASP A 85 ASP~? 11.55 O1 GOL B 3 B 275 HIS B 53 HIS~? 4.97 C1 GOL B 3 coo 34.84 56.77 81.62 34.95 54.74 82.03 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 43.18 49.30 68.39 44.75 49.87 69.78 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 38.73 55.10 77.62 36.80 55.01 78.46 -23.08 27.98 11.02 -22.64 29.79 10.05 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 B 107 ASP B 50 ASP~? -2.86 O3 GOL B 3s B 246 ASP B 60 ASP~? 9.78 O3 GOL B 4 B 275 HIS B 53 HIS~? 4.97 C1 GOL B 3 coo 34.84 56.77 81.62 34.95 54.74 82.03 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 43.18 49.30 68.39 44.75 49.87 69.78 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 38.73 55.10 77.62 36.80 55.01 78.46 -23.08 27.98 11.02 -22.64 29.79 10.05 1ehy_c01 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 3 hits 1ehy_c01 naa= 3 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 D 107 ASP A 50 ASP~? 20.38 O1 GOL B 3 D 246 ASP A 60 ASP~? 16.34 O3 GOL A 2 D 275 HIS A 53 HIS~? 22.15 O3 GOL B 4 coo 37.41 19.89 81.58 37.64 21.98 81.53 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 23.50 26.43 88.52 24.76 26.47 90.29 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 33.16 21.44 85.29 34.07 21.53 83.40 -6.79 29.31 17.48 -5.37 29.37 19.01 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 D 107 ASP B 50 ASP~? -2.86 O3 GOL B 3s D 246 ASP B 60 ASP~? 9.78 O3 GOL B 4 D 275 HIS B 53 HIS~? 4.97 C1 GOL B 3 coo 37.41 19.89 81.58 37.64 21.98 81.53 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 23.50 26.43 88.52 24.76 26.47 90.29 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 33.16 21.44 85.29 34.07 21.53 83.40 -23.08 27.98 11.02 -22.64 29.79 10.05 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 64 ALA~? 10.51 O3 GOL A 2 A 257 ALA A 66 ALA~? -4.16 O3 GOL A 2s A 328 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 39.84 24.12 8.44 38.50 24.23 9.11 -12.48 15.28 6.50 -13.49 15.72 7.59 coo 43.22 26.73 5.37 41.81 27.09 5.79 -11.18 15.09 1.17 -9.76 15.59 1.18 coo 38.17 34.10 6.67 37.72 32.06 6.84 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA A 66 ALA~? -4.16 O3 GOL A 2s A 257 ALA A 64 ALA~? 10.51 O3 GOL A 2 A 328 ASP A 60 ASP~? 16.34 O3 GOL A 2 coo 39.84 24.12 8.44 38.50 24.23 9.11 -11.18 15.09 1.17 -9.76 15.59 1.18 coo 43.22 26.73 5.37 41.81 27.09 5.79 -12.48 15.28 6.50 -13.49 15.72 7.59 coo 38.17 34.10 6.67 37.72 32.06 6.84 -10.35 19.90 11.39 -8.96 19.35 12.87 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 # 3 A 229 ALA A 67 ALA~? 7.17 O3 GOL A 2 A 257 ALA A 64 ALA~? 10.51 O3 GOL A 2 A 328 ASP A 60 ASP~? 16.34 O3 GOL A 2 coo 39.84 24.12 8.44 38.50 24.23 9.11 -11.26 11.84 3.16 -11.02 11.64 4.67 coo 43.22 26.73 5.37 41.81 27.09 5.79 -12.48 15.28 6.50 -13.49 15.72 7.59 coo 38.17 34.10 6.67 37.72 32.06 6.84 -10.35 19.90 11.39 -8.96 19.35 12.87 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 # 4 A 229 ALA B 64 ALA~? 12.60 O1 SO4 B 1 A 257 ALA B 66 ALA~? 10.36 O1 SO4 B 1 A 328 ASP B 74 ASP~? -3.22 O1 SO4 B 1s coo 39.84 24.12 8.44 38.50 24.23 9.11 -24.36 20.54 28.36 -25.43 21.44 27.83 coo 43.22 26.73 5.37 41.81 27.09 5.79 -22.61 15.40 29.42 -21.33 15.35 28.67 coo 38.17 34.10 6.67 37.72 32.06 6.84 -31.73 12.15 27.06 -32.07 10.54 28.42 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 5 3 # 5 A 229 ALA B 66 ALA~? 10.36 O1 SO4 B 1 A 257 ALA B 64 ALA~? 12.60 O1 SO4 B 1 A 328 ASP B 60 ASP~? 9.78 O3 GOL B 4 coo 39.84 24.12 8.44 38.50 24.23 9.11 -22.61 15.40 29.42 -21.33 15.35 28.67 coo 43.22 26.73 5.37 41.81 27.09 5.79 -24.36 20.54 28.36 -25.43 21.44 27.83 coo 38.17 34.10 6.67 37.72 32.06 6.84 -23.30 24.41 22.44 -21.92 26.02 22.10 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 6 3 # 6 A 229 ALA B 67 ALA~? 12.29 O4 SO4 B 1 A 257 ALA B 64 ALA~? 12.60 O1 SO4 B 1 A 328 ASP B 60 ASP~? 9.78 O3 GOL B 4 coo 39.84 24.12 8.44 38.50 24.23 9.11 -22.11 17.99 32.20 -22.02 19.44 32.03 coo 43.22 26.73 5.37 41.81 27.09 5.79 -24.36 20.54 28.36 -25.43 21.44 27.83 coo 38.17 34.10 6.67 37.72 32.06 6.84 -23.30 24.41 22.44 -21.92 26.02 22.10 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 7 3 # 7 A 229 ALA B 91 ALA~? -4.17 C1 GOL B 4s A 257 ALA B 89 ALA~? 7.42 O1 GOL B 4 A 328 ASP B 85 ASP~? 11.13 O1 GOL B 4 coo 39.84 24.12 8.44 38.50 24.23 9.11 -28.47 25.43 9.73 -27.26 24.61 9.42 coo 43.22 26.73 5.37 41.81 27.09 5.79 -32.18 21.73 7.50 -33.49 20.97 7.68 coo 38.17 34.10 6.67 37.72 32.06 6.84 -32.24 14.59 8.46 -32.94 14.97 6.62 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 7 hits 1eo7_c00 naa= 3 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 159 LYS B 92 LYS~? 4.07 O3 GOL B 3 A 193 GLU B 86 GLU~? 9.00 O1 GOL B 4 A 217 VAL B 88 VAL~? 6.63 C1 GOL B 4 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -29.46 26.70 6.25 -26.96 24.00 2.30 coo -5.33 11.71 69.72 -4.62 11.92 67.73 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 0.07 12.29 66.53 -0.24 11.95 64.38 -28.80 20.61 8.52 -27.68 19.63 6.99 1et0_c00 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 1 hits 1et0_c00 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP A 50 ASP~? 20.38 O1 GOL B 3 260 GLU A 57 GLU~? 16.18 C3 GOL B 4 370 TYR A 56 TYR~? 21.37 C3 GOL A 2 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 -4.76 25.74 13.22 -2.26 27.02 13.36 ULMN 3 1euu_c00 SIALIDASE user 2 3 # 2 92 ASP B 50 ASP~? -2.86 O3 GOL B 3s 260 GLU B 57 GLU~? -4.12 O3 GOL B 4s 370 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 -18.76 26.04 16.25 -16.06 26.60 15.60 1euu_c00 source 1euu SIALIDASE : 2 hits 1euu_c00 naa= 3 ULMN 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 1 3 # 1 A 68 ASP B 79 ASP~? 15.24 O1 GOL B 4 A 74 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 98 GLU B 86 GLU~? 9.00 O1 GOL B 4 coo 17.19 9.05 25.28 15.77 9.98 26.53 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 15.99 8.54 17.36 14.96 7.80 19.05 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 16.31 12.85 18.11 16.71 11.79 19.90 -35.32 17.29 11.75 -36.56 18.30 10.39 1eyi_c00 source 1eyi FRUCTOSE-1,6-BISPHOSPHATASE : 1 hits 1eyi_c00 naa= 3 ULMN 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 3 # 1 C 95 ASP A 60 ASP~? 16.34 O3 GOL A 2 C 117 GLU A 63 GLU~? 12.00 O3 GOL A 2 C 131 GLU A 57 GLU~? 16.18 C3 GOL B 4 coo 68.01 56.37 72.57 68.42 56.10 70.51 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 66.59 62.50 67.44 67.57 60.64 67.12 -6.94 17.09 6.76 -5.68 16.32 8.28 coo 69.24 52.27 71.96 69.91 50.26 71.89 -11.51 25.36 14.24 -11.92 23.60 15.35 ULMN 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 2 3 # 2 C 95 ASP B 60 ASP~? 9.78 O3 GOL B 4 C 117 GLU B 63 GLU~? 15.70 C2 GOL B 4 C 131 GLU B 57 GLU~? -4.12 O3 GOL B 4s coo 68.01 56.37 72.57 68.42 56.10 70.51 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 66.59 62.50 67.44 67.57 60.64 67.12 -18.99 20.23 25.46 -17.68 21.89 25.23 coo 69.24 52.27 71.96 69.91 50.26 71.89 -25.78 25.15 16.73 -26.80 26.19 18.23 1f6d_c02 source 1f6d UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE : 2 hits 1f6d_c02 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE B 33 PHE~? 12.08 C1 GOL B 4 A 210 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 244 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 9.23 46.77 25.11 11.48 48.39 24.76 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 10.51 37.86 19.71 9.07 39.38 20.04 -10.35 19.90 11.39 -8.96 19.35 12.87 coo -1.20 42.34 17.67 3.19 45.13 19.06 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 112 PHE B 33 PHE~? 12.08 C1 GOL B 4 A 210 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 244 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 9.23 46.77 25.11 11.48 48.39 24.76 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 10.51 37.86 19.71 9.07 39.38 20.04 -23.30 24.41 22.44 -21.92 26.02 22.10 coo -1.20 42.34 17.67 3.19 45.13 19.06 -9.77 24.33 22.44 -10.89 19.77 26.71 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 B 33 PHE~? 12.08 C1 GOL B 4 B 210 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 244 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 8.76 47.85 34.91 11.08 46.36 35.41 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 9.06 56.85 40.30 7.71 55.27 39.90 -10.35 19.90 11.39 -8.96 19.35 12.87 coo -2.38 51.82 41.62 2.07 49.19 40.42 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 112 PHE B 33 PHE~? 12.08 C1 GOL B 4 B 210 ASP B 60 ASP~? 9.78 O3 GOL B 4 B 244 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 8.76 47.85 34.91 11.08 46.36 35.41 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 9.06 56.85 40.30 7.71 55.27 39.90 -23.30 24.41 22.44 -21.92 26.02 22.10 coo -2.38 51.82 41.62 2.07 49.19 40.42 -9.77 24.33 22.44 -10.89 19.77 26.71 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 39 TYR~? 14.11 O2 GOL B 3 A 142 LEU A 87 LEU~? 10.16 O2 GOL B 3 A 165 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 -14.42 31.83 7.41 -13.85 29.77 7.64 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR B 15 TYR.? 18.41 O3 GOL B 4 A 142 LEU A 52 LEU~? 22.97 O2 GOL B 3 A 165 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 -9.10 28.01 20.14 -10.98 27.06 18.31 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 -3.59 30.93 13.59 -1.64 31.39 12.76 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 -9.77 24.33 22.44 -10.89 19.77 26.71 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 39 TYR~? 14.11 O2 GOL B 3 B 142 LEU A 87 LEU~? 10.16 O2 GOL B 3 B 165 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 -14.42 31.83 7.41 -13.85 29.77 7.64 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR B 15 TYR.? 18.41 O3 GOL B 4 B 142 LEU A 52 LEU~? 22.97 O2 GOL B 3 B 165 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 -9.10 28.01 20.14 -10.98 27.06 18.31 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 -3.59 30.93 13.59 -1.64 31.39 12.76 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 -9.77 24.33 22.44 -10.89 19.77 26.71 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR A 39 TYR~? 14.11 O2 GOL B 3 C 142 LEU A 87 LEU~? 10.16 O2 GOL B 3 C 165 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 -14.42 31.83 7.41 -13.85 29.77 7.64 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 137 TYR B 15 TYR.? 18.41 O3 GOL B 4 C 142 LEU A 52 LEU~? 22.97 O2 GOL B 3 C 165 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 -9.10 28.01 20.14 -10.98 27.06 18.31 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 -3.59 30.93 13.59 -1.64 31.39 12.76 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 -9.77 24.33 22.44 -10.89 19.77 26.71 1fdy_c02 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c02 naa= 3 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 137 TYR A 39 TYR~? 14.11 O2 GOL B 3 D 142 LEU A 87 LEU~? 10.16 O2 GOL B 3 D 165 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 -14.42 31.83 7.41 -13.85 29.77 7.64 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR B 15 TYR.? 18.41 O3 GOL B 4 D 142 LEU A 52 LEU~? 22.97 O2 GOL B 3 D 165 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 -9.10 28.01 20.14 -10.98 27.06 18.31 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 -3.59 30.93 13.59 -1.64 31.39 12.76 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 -9.77 24.33 22.44 -10.89 19.77 26.71 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c03 naa= 3 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 1 3 # 1 A 54 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 281 ARG A 70 ARG.? 9.89 O2 GOL A 2s A 289 TYR A 29 TYR~? -4.87 O1 GOL A 2s coo 54.86 40.00 47.23 55.57 38.60 48.67 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 52.08 40.18 50.14 50.83 38.93 47.73 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 57.82 31.70 50.73 57.94 34.00 49.17 -9.33 19.89 -0.73 -11.85 18.67 -0.31 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 2 3 # 2 A 54 ASP B 74 ASP~? -3.22 O1 SO4 B 1s A 281 ARG B 70 ARG.? -4.45 O4 SO4 B 1s A 289 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 54.86 40.00 47.23 55.57 38.60 48.67 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 52.08 40.18 50.14 50.83 38.93 47.73 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 57.82 31.70 50.73 57.94 34.00 49.17 -22.35 12.75 24.72 -24.49 13.46 26.40 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 74 ASP~? -7.66 O2 GOL A 2s B 281 ARG A 70 ARG.? 9.89 O2 GOL A 2s B 289 TYR A 29 TYR~? -4.87 O1 GOL A 2s coo 90.56 80.24 98.04 90.36 81.53 96.34 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 86.62 80.67 97.51 87.37 82.00 100.10 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 91.83 88.28 92.88 92.60 85.93 94.14 -9.33 19.89 -0.73 -11.85 18.67 -0.31 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 2 3 # 2 B 54 ASP B 74 ASP~? -3.22 O1 SO4 B 1s B 281 ARG B 70 ARG.? -4.45 O4 SO4 B 1s B 289 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 90.56 80.24 98.04 90.36 81.53 96.34 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 86.62 80.67 97.51 87.37 82.00 100.10 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 91.83 88.28 92.88 92.60 85.93 94.14 -22.35 12.75 24.72 -24.49 13.46 26.40 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 74 ASP~? -7.66 O2 GOL A 2s C 281 ARG A 70 ARG.? 9.89 O2 GOL A 2s C 289 TYR A 29 TYR~? -4.87 O1 GOL A 2s coo 42.34 76.83 49.10 43.06 78.59 50.01 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 46.12 77.15 48.13 44.44 77.61 45.70 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 42.69 86.18 51.69 41.59 83.63 51.54 -9.33 19.89 -0.73 -11.85 18.67 -0.31 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 2 3 # 2 C 54 ASP B 74 ASP~? -3.22 O1 SO4 B 1s C 281 ARG B 70 ARG.? -4.45 O4 SO4 B 1s C 289 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 42.34 76.83 49.10 43.06 78.59 50.01 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 46.12 77.15 48.13 44.44 77.61 45.70 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 42.69 86.18 51.69 41.59 83.63 51.54 -22.35 12.75 24.72 -24.49 13.46 26.40 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 74 ASP~? -7.66 O2 GOL A 2s D 281 ARG A 70 ARG.? 9.89 O2 GOL A 2s D 289 TYR A 29 TYR~? -4.87 O1 GOL A 2s coo 75.05 45.80 106.18 74.73 43.88 105.51 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 78.52 44.93 104.78 78.72 44.49 107.76 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 72.35 36.51 104.82 72.00 39.20 105.46 -9.33 19.89 -0.73 -11.85 18.67 -0.31 ULMN 3 1foh_c03 PHENOL HYDROXYLASE user 2 3 # 2 D 54 ASP B 74 ASP~? -3.22 O1 SO4 B 1s D 281 ARG B 70 ARG.? -4.45 O4 SO4 B 1s D 289 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 75.05 45.80 106.18 74.73 43.88 105.51 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 78.52 44.93 104.78 78.72 44.49 107.76 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 72.35 36.51 104.82 72.00 39.20 105.46 -22.35 12.75 24.72 -24.49 13.46 26.40 1foh_c03 source 1foh PHENOL HYDROXYLASE : 2 hits 1foh_c03 naa= 3 ULMN 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 A 317 GLU A 78 GLU.? 14.22 O2 GOL B 3 A 319 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 359 ARG A 70 ARG.? 9.89 O2 GOL A 2s coo 14.41 12.40 16.42 12.92 13.74 15.71 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo 12.25 13.04 23.85 11.56 15.02 23.93 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 10.89 14.95 28.28 12.39 12.53 29.31 -18.90 15.15 -0.51 -21.15 17.20 -0.06 1fr8_c00 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c00 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU A 78 GLU.? 14.22 O2 GOL B 3 B 319 ASP A 74 ASP~? -7.66 O2 GOL A 2s B 359 ARG A 70 ARG.? 9.89 O2 GOL A 2s coo 10.77 13.13 40.94 11.03 14.73 39.51 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo 3.77 12.64 38.21 3.35 14.53 37.39 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo -1.16 15.32 35.60 -3.32 13.56 36.98 -18.90 15.15 -0.51 -21.15 17.20 -0.06 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c01 naa= 3 ULMN 3 1fuq_c00 FUMARASE C user 1 3 # 1 A 324 LYS B 92 LYS~? 4.07 O3 GOL B 3 A 331 GLU A 86 GLU~? -2.98 O1 GOL B 3s B 188 HIS B 53 HIS~? 4.97 C1 GOL B 3 coo 130.22 155.23 83.49 125.21 153.71 84.04 -29.46 26.70 6.25 -26.96 24.00 2.30 coo 120.90 152.23 75.28 120.94 153.09 77.19 -20.52 33.51 6.85 -21.94 32.18 6.04 coo 122.04 152.80 81.06 120.71 154.37 81.46 -23.08 27.98 11.02 -22.64 29.79 10.05 ULMN 3 1fuq_c00 FUMARASE C user 2 3 # 2 A 324 LYS B 92 LYS~? 4.07 O3 GOL B 3 A 331 GLU B 57 GLU~? -4.12 O3 GOL B 4s B 188 HIS B 53 HIS~? 4.97 C1 GOL B 3 coo 130.22 155.23 83.49 125.21 153.71 84.04 -29.46 26.70 6.25 -26.96 24.00 2.30 coo 120.90 152.23 75.28 120.94 153.09 77.19 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 122.04 152.80 81.06 120.71 154.37 81.46 -23.08 27.98 11.02 -22.64 29.79 10.05 1fuq_c00 source 1fuq FUMARASE C : 2 hits 1fuq_c00 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 14 GLU~? -24.52 O3 GOL A 2s A 47 ASP A 50 ASP~? 20.38 O1 GOL B 3 A 161 TYR A 56 TYR~? 21.37 C3 GOL A 2 coo 37.12 18.35 73.76 37.09 16.69 72.44 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 29.81 8.06 73.13 30.21 10.11 72.95 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 37.29 15.56 67.90 37.37 13.79 70.08 -4.76 25.74 13.22 -2.26 27.02 13.36 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 14 GLU~? -24.52 O3 GOL A 2s B 47 ASP A 50 ASP~? 20.38 O1 GOL B 3 B 161 TYR A 56 TYR~? 21.37 C3 GOL A 2 coo 53.87 35.49 53.22 55.44 35.72 54.61 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 63.47 43.65 53.95 61.45 43.07 54.06 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 56.38 35.81 59.19 58.25 35.77 57.10 -4.76 25.74 13.22 -2.26 27.02 13.36 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c03 naa= 3 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 # 1 B 106 ASN A 90 ASN~? 6.78 O1 GOL B 3 B 108 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 144 ASP B 60 ASP~? 9.78 O3 GOL B 4 coo 36.64 101.02 13.15 38.55 101.84 12.78 -18.60 32.80 11.91 -20.33 33.24 10.71 coo 41.00 107.18 12.86 42.70 107.82 11.96 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 31.60 110.69 6.14 29.69 109.74 5.94 -23.30 24.41 22.44 -21.92 26.02 22.10 1grc_c03 source 1grc GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE (E.C: 1 hits 1grc_c03 naa= 3 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 A 189 PHE A 43 PHE~? 17.67 O2 GOL B 3 A 298 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 -10.55 41.39 3.11 -10.71 42.10 0.46 coo 2.59 0.29 25.55 4.65 0.18 25.07 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 12.42 6.10 23.27 9.95 1.57 20.16 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 A 189 PHE A 62 PHE~? 10.05 O1 GOL A 2 A 298 ASP A 28 ASP~? -5.64 O1 GOL A 2s A 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 -10.46 22.36 3.39 -11.36 24.71 2.13 coo 2.59 0.29 25.55 4.65 0.18 25.07 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 12.42 6.10 23.27 9.95 1.57 20.16 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 A 189 PHE B 33 PHE~? 12.08 C1 GOL B 4 A 298 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 329 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 2.59 0.29 25.55 4.65 0.18 25.07 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 12.42 6.10 23.27 9.95 1.57 20.16 -9.77 24.33 22.44 -10.89 19.77 26.71 1gtx_c00 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c00 naa= 3 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 B 189 PHE A 43 PHE~? 17.67 O2 GOL B 3 B 298 ASP A 85 ASP~? 11.55 O1 GOL B 3 B 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 -10.55 41.39 3.11 -10.71 42.10 0.46 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 B 189 PHE A 62 PHE~? 10.05 O1 GOL A 2 B 298 ASP A 28 ASP~? -5.64 O1 GOL A 2s B 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 -10.46 22.36 3.39 -11.36 24.71 2.13 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 B 189 PHE B 33 PHE~? 12.08 C1 GOL B 4 B 298 ASP B 60 ASP~? 9.78 O3 GOL B 4 B 329 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 -9.77 24.33 22.44 -10.89 19.77 26.71 1gtx_c01 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c01 naa= 3 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 C 189 PHE A 43 PHE~? 17.67 O2 GOL B 3 C 298 ASP A 85 ASP~? 11.55 O1 GOL B 3 C 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 17.41 60.57 64.39 18.40 58.12 65.34 -10.55 41.39 3.11 -10.71 42.10 0.46 coo 24.10 66.43 63.33 24.18 64.30 63.40 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 27.64 56.61 58.17 22.18 57.92 60.36 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 C 189 PHE A 62 PHE~? 10.05 O1 GOL A 2 C 298 ASP A 28 ASP~? -5.64 O1 GOL A 2s C 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 17.41 60.57 64.39 18.40 58.12 65.34 -10.46 22.36 3.39 -11.36 24.71 2.13 coo 24.10 66.43 63.33 24.18 64.30 63.40 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 27.64 56.61 58.17 22.18 57.92 60.36 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 C 189 PHE B 33 PHE~? 12.08 C1 GOL B 4 C 298 ASP B 60 ASP~? 9.78 O3 GOL B 4 C 329 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 17.41 60.57 64.39 18.40 58.12 65.34 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 24.10 66.43 63.33 24.18 64.30 63.40 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 27.64 56.61 58.17 22.18 57.92 60.36 -9.77 24.33 22.44 -10.89 19.77 26.71 1gtx_c02 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c02 naa= 3 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 D 189 PHE A 43 PHE~? 17.67 O2 GOL B 3 D 298 ASP A 85 ASP~? 11.55 O1 GOL B 3 D 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 35.44 53.35 83.81 35.65 54.53 81.28 -10.55 41.39 3.11 -10.71 42.10 0.46 coo 29.72 46.46 83.60 30.79 47.36 81.99 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 36.89 44.91 74.55 37.33 48.94 79.01 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 D 189 PHE A 62 PHE~? 10.05 O1 GOL A 2 D 298 ASP A 28 ASP~? -5.64 O1 GOL A 2s D 329 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 35.44 53.35 83.81 35.65 54.53 81.28 -10.46 22.36 3.39 -11.36 24.71 2.13 coo 29.72 46.46 83.60 30.79 47.36 81.99 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 36.89 44.91 74.55 37.33 48.94 79.01 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 D 189 PHE B 33 PHE~? 12.08 C1 GOL B 4 D 298 ASP B 60 ASP~? 9.78 O3 GOL B 4 D 329 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 35.44 53.35 83.81 35.65 54.53 81.28 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 29.72 46.46 83.60 30.79 47.36 81.99 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 36.89 44.91 74.55 37.33 48.94 79.01 -9.77 24.33 22.44 -10.89 19.77 26.71 1gtx_c03 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c03 naa= 3 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 1 3 # 1 A 267 GLU A 14 GLU~? -24.52 O3 GOL A 2s A 369 ARG A 21 ARG~? 15.66 O3 GOL A 2 A 372 TYR A 56 TYR~? 21.37 C3 GOL A 2 coo 16.47 7.99 31.03 17.36 6.90 32.63 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 -2.39 18.19 10.15 -5.10 18.35 11.53 coo 16.01 4.58 27.39 13.82 5.38 28.94 -4.76 25.74 13.22 -2.26 27.02 13.36 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 2 3 # 2 A 267 GLU A 57 GLU~? 16.18 C3 GOL B 4 A 369 ARG B 21 ARG.? 13.55 O3 GOL B 4 A 372 TYR B 15 TYR.? 18.41 O3 GOL B 4 coo 16.47 7.99 31.03 17.36 6.90 32.63 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 -14.41 22.89 22.20 -17.07 24.46 22.16 coo 16.01 4.58 27.39 13.82 5.38 28.94 -9.10 28.01 20.14 -10.98 27.06 18.31 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 3 3 # 3 A 267 GLU B 14 GLU.? 23.95 O3 GOL B 4 A 369 ARG B 21 ARG.? 13.55 O3 GOL B 4 A 372 TYR B 15 TYR.? 18.41 O3 GOL B 4 coo 16.47 7.99 31.03 17.36 6.90 32.63 -6.12 30.69 25.05 -7.11 32.53 25.27 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 -14.41 22.89 22.20 -17.07 24.46 22.16 coo 16.01 4.58 27.39 13.82 5.38 28.94 -9.10 28.01 20.14 -10.98 27.06 18.31 1i1e_c00 source 1i1e BOTULINUM NEUROTOXIN TYPE B : 3 hits 1i1e_c00 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 22 VAL~? 12.54 O1 GOL A 2 A 200 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 226 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -2.56 21.20 3.77 -3.10 23.33 3.68 coo 24.51 43.28 11.18 25.17 44.50 9.58 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 34.47 51.09 7.19 28.58 51.18 7.53 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1i29_c03 CSDB user 2 3 # 2 A 128 VAL A 32 VAL~? 10.12 O1 GOL A 2 A 200 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 226 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -8.57 26.99 -2.23 -10.61 26.41 -2.57 coo 24.51 43.28 11.18 25.17 44.50 9.58 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 34.47 51.09 7.19 28.58 51.18 7.53 -29.46 26.70 6.25 -26.96 24.00 2.30 ULMN 3 1i29_c03 CSDB user 3 3 # 3 A 128 VAL B 32 VAL~? 13.60 O1 SO4 B 1 A 200 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 226 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -23.12 9.96 18.05 -25.09 10.01 19.03 coo 24.51 43.28 11.18 25.17 44.50 9.58 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 34.47 51.09 7.19 28.58 51.18 7.53 -29.46 26.70 6.25 -26.96 24.00 2.30 ULMN 3 1i29_c03 CSDB user 4 3 # 4 A 128 VAL B 72 VAL~? 8.09 O1 SO4 B 1 A 200 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 226 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -26.79 11.31 24.60 -25.57 10.68 22.84 coo 24.51 43.28 11.18 25.17 44.50 9.58 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 34.47 51.09 7.19 28.58 51.18 7.53 -9.77 24.33 22.44 -10.89 19.77 26.71 1i29_c03 source 1i29 CSDB : 4 hits 1i29_c03 naa= 3 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 # 1 54 ASP A 79 ASP~? 10.37 O2 GOL B 3 158 THR A 76 THR~? 10.21 O2 GOL B 3 317 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo -2.63 8.40 35.07 -3.66 9.81 36.17 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -5.30 12.75 41.86 -4.34 13.05 39.99 -16.80 26.53 0.10 -14.78 26.55 -0.66 coo -12.63 17.64 33.66 -10.65 17.90 34.40 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 2 3 # 2 54 ASP B 74 ASP~? -3.22 O1 SO4 B 1s 158 THR B 76 THR~? 11.27 O1 SO4 B 1 317 ASP B 60 ASP~? 9.78 O3 GOL B 4 coo -2.63 8.40 35.07 -3.66 9.81 36.17 -31.73 12.15 27.06 -32.07 10.54 28.42 coo -5.30 12.75 41.86 -4.34 13.05 39.99 -30.92 13.53 20.08 -29.12 12.38 19.81 coo -12.63 17.64 33.66 -10.65 17.90 34.40 -23.30 24.41 22.44 -21.92 26.02 22.10 1inp_c02 source 1inp INOSITOL POLYPHOSPHATE 1-PHOSPHATASE (1-PTASE): 2 hits 1inp_c02 naa= 3 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 # 1 A 14 GLU A 86 GLU~? -2.98 O1 GOL B 3s A 61 GLU A 57 GLU~? 16.18 C3 GOL B 4 A 162 HIS B 53 HIS~? 4.97 C1 GOL B 3 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 -20.52 33.51 6.85 -21.94 32.18 6.04 coo -4.89 20.85 5.22 -3.95 21.69 6.91 -11.51 25.36 14.24 -11.92 23.60 15.35 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 -23.08 27.98 11.02 -22.64 29.79 10.05 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 # 2 A 14 GLU B 57 GLU~? -4.12 O3 GOL B 4s A 61 GLU A 57 GLU~? 16.18 C3 GOL B 4 A 162 HIS B 53 HIS~? 4.97 C1 GOL B 3 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 -25.78 25.15 16.73 -26.80 26.19 18.23 coo -4.89 20.85 5.22 -3.95 21.69 6.91 -11.51 25.36 14.24 -11.92 23.60 15.35 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 -23.08 27.98 11.02 -22.64 29.79 10.05 1j53_c00 source 1j53 DNA POLYMERASE III, EPSILON CHAIN : 2 hits 1j53_c00 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 57 GLU~? 16.18 C3 GOL B 4 A 56 LYS B 16 LYS.? 21.80 O1 SO4 B 1 A 258 ARG A 21 ARG~? 15.66 O3 GOL A 2 coo 42.33 1.56 26.99 42.38 2.91 28.66 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 38.45 -0.44 19.89 37.36 0.90 25.90 -9.77 24.33 22.44 -10.89 19.77 26.71 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 -2.39 18.19 10.15 -5.10 18.35 11.53 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 1 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 57 GLU~? 16.18 C3 GOL B 4 B 56 LYS B 16 LYS.? 21.80 O1 SO4 B 1 B 258 ARG A 21 ARG~? 15.66 O3 GOL A 2 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 -9.77 24.33 22.44 -10.89 19.77 26.71 coo 2.64 1.83 34.81 1.56 1.13 32.02 -2.39 18.19 10.15 -5.10 18.35 11.53 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 57 GLU~? 16.18 C3 GOL B 4 C 56 LYS B 16 LYS.? 21.80 O1 SO4 B 1 C 258 ARG A 21 ARG~? 15.66 O3 GOL A 2 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 -9.77 24.33 22.44 -10.89 19.77 26.71 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 -2.39 18.19 10.15 -5.10 18.35 11.53 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 57 GLU~? 16.18 C3 GOL B 4 D 56 LYS B 16 LYS.? 21.80 O1 SO4 B 1 D 258 ARG A 21 ARG~? 15.66 O3 GOL A 2 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 -9.77 24.33 22.44 -10.89 19.77 26.71 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 -2.39 18.19 10.15 -5.10 18.35 11.53 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 1 hits 1k82_c03 naa= 3 ULMN 3 1kdg_c02 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 A 609 TYR B 56 TYR~? 10.55 O3 GOL B 4 A 689 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 732 ASN A 90 ASN~? 6.78 O1 GOL B 3 coo 22.52 29.89 18.33 23.85 28.06 20.03 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 24.46 23.36 17.42 25.88 24.61 18.33 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 27.06 24.40 21.98 27.51 26.43 21.46 -18.60 32.80 11.91 -20.33 33.24 10.71 1kdg_c02 source 1kdg CELLOBIOSE DEHYDROGENASE : 1 hits 1kdg_c02 naa= 3 ULMN 3 1kdg_c03 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 B 609 TYR B 56 TYR~? 10.55 O3 GOL B 4 B 689 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 732 ASN A 90 ASN~? 6.78 O1 GOL B 3 coo 25.77 15.27 -24.02 28.47 14.70 -24.59 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 31.55 17.32 -20.91 31.51 15.29 -21.43 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 33.56 13.69 -24.17 31.95 12.28 -24.00 -18.60 32.80 11.91 -20.33 33.24 10.71 1kdg_c03 source 1kdg CELLOBIOSE DEHYDROGENASE : 1 hits 1kdg_c03 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA B 45 ALA.? -8.70 O3 GOL B 3s A 317 GLY B 46 GLY.? 6.70 O3 GOL B 3 A 318 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -27.02 19.29 1.20 -28.28 19.86 0.63 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -24.88 21.02 3.88 -24.62 20.77 3.13 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -24.34 23.91 6.60 -25.45 25.08 5.29 1lij_c01 source 1lij ADENOSINE KINASE : 1 hits 1lij_c01 naa= 3 ULMN 3 1m53_c03 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 295 GLU B 86 GLU~? 9.00 O1 GOL B 4 A 369 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 11.74 38.14 80.19 10.63 36.40 80.65 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 16.11 33.72 80.99 14.10 33.54 81.63 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 12.19 31.08 87.29 11.13 32.66 86.38 -34.62 8.62 14.62 -34.31 8.46 12.53 1m53_c03 source 1m53 ISOMALTULOSE SYNTHASE : 1 hits 1m53_c03 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 279 GLU B 57 GLU~? -4.12 O3 GOL B 4s A 369 ASP A 28 ASP~? -5.64 O1 GOL A 2s coo 11.74 38.14 80.19 10.63 36.40 80.65 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 16.54 46.37 63.94 14.77 45.79 62.95 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 12.19 31.08 87.29 11.13 32.66 86.38 -8.78 21.17 -6.27 -8.56 20.83 -8.37 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 279 GLU B 63 GLU~? 15.70 C2 GOL B 4 A 369 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 11.74 38.14 80.19 10.63 36.40 80.65 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 16.54 46.37 63.94 14.77 45.79 62.95 -18.99 20.23 25.46 -17.68 21.89 25.23 coo 12.19 31.08 87.29 11.13 32.66 86.38 -18.93 20.14 -2.22 -19.22 19.03 -4.07 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c06 naa= 3 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 # 1 A 465 GLY A 69 GLY~? 3.97 O3 GOL A 2 A 501 ASP A 79 ASP~? 10.37 O2 GOL B 3 B 367 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 -14.26 12.15 -1.29 -14.66 12.71 -0.87 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 -22.35 12.75 24.72 -24.49 13.46 26.40 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 # 2 A 465 GLY A 69 GLY~? 3.97 O3 GOL A 2 A 501 ASP B 85 ASP~? 11.13 O1 GOL B 4 B 367 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 -14.26 12.15 -1.29 -14.66 12.71 -0.87 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 2.18 28.14 10.75 1.63 29.43 8.35 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 # 3 A 465 GLY A 77 GLY~? 8.02 O2 GOL B 3 A 501 ASP B 85 ASP~? 11.13 O1 GOL B 4 B 367 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 -19.25 27.20 -2.68 -18.38 27.18 -2.65 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 2.18 28.14 10.75 1.63 29.43 8.35 1mro_c00 source 1mro METHYL-COENZYME M REDUCTASE : 3 hits 1mro_c00 naa= 3 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 # 1 D 465 GLY A 69 GLY~? 3.97 O3 GOL A 2 D 501 ASP A 79 ASP~? 10.37 O2 GOL B 3 E 367 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 -14.26 12.15 -1.29 -14.66 12.71 -0.87 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 -22.35 12.75 24.72 -24.49 13.46 26.40 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 # 2 D 465 GLY A 69 GLY~? 3.97 O3 GOL A 2 D 501 ASP B 85 ASP~? 11.13 O1 GOL B 4 E 367 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 -14.26 12.15 -1.29 -14.66 12.71 -0.87 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 2.18 28.14 10.75 1.63 29.43 8.35 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 # 3 D 465 GLY A 77 GLY~? 8.02 O2 GOL B 3 D 501 ASP B 85 ASP~? 11.13 O1 GOL B 4 E 367 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 -19.25 27.20 -2.68 -18.38 27.18 -2.65 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 2.18 28.14 10.75 1.63 29.43 8.35 1mro_c01 source 1mro METHYL-COENZYME M REDUCTASE : 3 hits 1mro_c01 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 197 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 223 ALA A 84 ALA~? 11.62 O2 GOL B 3 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 -23.08 27.98 11.02 -22.64 29.79 10.05 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 -24.34 23.91 6.60 -25.45 25.08 5.29 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 -13.79 33.34 3.78 -12.56 33.70 2.99 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 1 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 197 ASP B 50 ASP~? -2.86 O3 GOL B 3s B 223 ALA A 84 ALA~? 11.62 O2 GOL B 3 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 -23.08 27.98 11.02 -22.64 29.79 10.05 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 -24.34 23.91 6.60 -25.45 25.08 5.29 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 -13.79 33.34 3.78 -12.56 33.70 2.99 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 1 hits 1n2t_c03 naa= 3 ULMN 3 1naa_c02 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 A 609 TYR B 56 TYR~? 10.55 O3 GOL B 4 A 689 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 732 ASN A 90 ASN~? 6.78 O1 GOL B 3 coo 23.89 30.33 18.51 26.53 29.83 17.65 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 24.69 23.24 17.44 26.23 24.43 18.22 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 27.47 24.40 22.13 27.89 26.42 21.78 -18.60 32.80 11.91 -20.33 33.24 10.71 1naa_c02 source 1naa CELLOBIOSE DEHYDROGENASE : 1 hits 1naa_c02 naa= 3 ULMN 3 1naa_c03 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 B 609 TYR B 56 TYR~? 10.55 O3 GOL B 4 B 689 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 732 ASN A 90 ASN~? 6.78 O1 GOL B 3 coo 26.13 14.71 -23.89 27.40 13.01 -22.05 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 31.95 18.02 -21.08 31.88 15.94 -21.37 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 33.92 13.94 -24.42 32.27 12.62 -24.35 -18.60 32.80 11.91 -20.33 33.24 10.71 1naa_c03 source 1naa CELLOBIOSE DEHYDROGENASE : 1 hits 1naa_c03 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 A 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -3.50 124.89 25.05 -2.25 124.77 23.26 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 1.87 119.38 16.45 1.41 122.11 16.84 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -2.59 124.07 12.67 -0.91 126.17 18.42 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c00 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c00 naa= 3 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 B 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 B 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 B 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -7.43 109.06 51.23 -5.84 110.54 50.86 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 0.22 114.56 44.62 -0.76 115.18 47.18 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -4.18 120.17 46.85 -4.02 115.31 51.00 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c01 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c01 naa= 3 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 C 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 C 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 C 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -13.49 79.65 43.90 -12.13 80.29 45.45 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -5.65 86.78 48.49 -7.16 84.72 49.65 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -11.22 87.18 53.49 -10.94 81.64 50.31 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c02 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c02 naa= 3 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 D 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 D 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 D 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -13.44 77.36 13.12 -12.53 75.97 14.48 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -7.85 74.44 22.75 -9.22 72.86 20.89 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -14.24 70.61 23.48 -12.55 71.73 17.42 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c03 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c03 naa= 3 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 E 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 E 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 E 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -7.12 105.25 1.43 -6.30 103.34 0.77 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -3.11 94.55 3.01 -3.83 95.92 0.66 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c04 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c04 naa= 3 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 F 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 F 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 F 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -44.75 128.15 10.28 -45.68 129.67 11.55 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -50.43 131.90 19.60 -49.04 133.31 17.60 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -44.10 135.86 19.99 -45.67 134.21 14.07 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c05 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c05 naa= 3 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 G 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 G 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 G 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -44.97 128.78 41.20 -46.32 128.26 42.83 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -52.83 122.13 46.42 -51.31 124.30 47.39 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -47.30 122.24 51.49 -47.46 127.44 47.81 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c06 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c06 naa= 3 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 H 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 H 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 H 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -51.11 100.30 51.41 -52.67 98.82 51.12 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -58.70 94.17 45.32 -57.76 93.82 47.92 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -54.32 88.79 48.13 -54.61 94.04 51.74 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c07 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c07 naa= 3 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 I 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 I 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 I 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -54.65 81.97 26.87 -55.88 81.89 25.07 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -59.92 86.62 17.74 -59.42 83.94 18.40 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -55.38 81.61 14.50 -57.11 80.05 20.41 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c08 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c08 naa= 3 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 J 24 ASP A 79 ASP~? 10.37 O2 GOL B 3 J 146 TYR A 39 TYR~? 14.11 O2 GOL B 3 J 177 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo -50.64 99.08 1.52 -51.52 100.83 0.67 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 -10.75 36.73 1.72 -12.98 38.41 1.98 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1ok4_c09 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c09 naa= 3 ULMN 3 1oyg_c00 LEVANSUCRASE user 1 3 # 1 A 86 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 247 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 342 GLU A 86 GLU~? -2.98 O1 GOL B 3s coo 44.36 35.68 9.71 43.29 36.20 11.51 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 41.40 28.81 12.91 40.82 30.90 12.97 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 40.37 33.11 18.06 39.99 34.93 17.06 -20.52 33.51 6.85 -21.94 32.18 6.04 ULMN 3 1oyg_c00 LEVANSUCRASE user 2 3 # 2 A 86 ASP B 79 ASP~? 15.24 O1 GOL B 4 A 247 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 342 GLU B 86 GLU~? 9.00 O1 GOL B 4 coo 44.36 35.68 9.71 43.29 36.20 11.51 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 41.40 28.81 12.91 40.82 30.90 12.97 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 40.37 33.11 18.06 39.99 34.93 17.06 -35.32 17.29 11.75 -36.56 18.30 10.39 1oyg_c00 source 1oyg LEVANSUCRASE : 2 hits 1oyg_c00 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 23 ALA~? 14.06 O1 GOL A 2 A 126 LEU A 25 LEU.? 8.23 O1 GOL A 2 A 158 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -2.29 37.66 144.73 -1.46 37.12 145.87 0.20 19.97 1.49 1.66 20.11 1.80 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -5.34 18.64 0.93 -6.39 18.90 2.83 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 24 ALA~? 11.15 O3 GOL A 2 A 126 LEU A 25 LEU.? 8.23 O1 GOL A 2 A 158 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -1.14 16.43 1.85 -1.15 15.65 3.15 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -5.34 18.64 0.93 -6.39 18.90 2.83 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA B 23 ALA.? 21.21 O1 SO4 B 1 A 126 LEU B 25 LEU.? 14.25 O1 SO4 B 1 A 158 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -12.56 13.95 22.39 -11.09 14.05 21.99 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -17.85 14.16 24.50 -18.91 15.92 23.86 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA B 91 ALA~? -4.17 C1 GOL B 4s A 126 LEU B 87 LEU~? -3.96 O1 GOL B 4s A 158 GLU B 86 GLU~? 9.00 O1 GOL B 4 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -28.47 25.43 9.73 -27.26 24.61 9.42 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -28.62 19.24 12.63 -27.80 19.11 14.61 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -35.32 17.29 11.75 -36.56 18.30 10.39 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 23 ALA~? 14.06 O1 GOL A 2 B 126 LEU A 25 LEU.? 8.23 O1 GOL A 2 B 158 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -39.79 4.61 147.27 -39.61 5.56 148.47 0.20 19.97 1.49 1.66 20.11 1.80 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -5.34 18.64 0.93 -6.39 18.90 2.83 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA B 23 ALA.? 21.21 O1 SO4 B 1 B 126 LEU B 25 LEU.? 14.25 O1 SO4 B 1 B 158 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -12.56 13.95 22.39 -11.09 14.05 21.99 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -17.85 14.16 24.50 -18.91 15.92 23.86 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA B 91 ALA~? -4.17 C1 GOL B 4s B 126 LEU B 87 LEU~? -3.96 O1 GOL B 4s B 158 GLU B 86 GLU~? 9.00 O1 GOL B 4 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -28.47 25.43 9.73 -27.26 24.61 9.42 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -28.62 19.24 12.63 -27.80 19.11 14.61 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -35.32 17.29 11.75 -36.56 18.30 10.39 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 3 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 23 ALA~? 14.06 O1 GOL A 2 C 126 LEU A 25 LEU.? 8.23 O1 GOL A 2 C 158 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 0.20 19.97 1.49 1.66 20.11 1.80 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -5.34 18.64 0.93 -6.39 18.90 2.83 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 24 ALA~? 11.15 O3 GOL A 2 C 126 LEU A 25 LEU.? 8.23 O1 GOL A 2 C 158 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -1.14 16.43 1.85 -1.15 15.65 3.15 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -5.34 18.64 0.93 -6.39 18.90 2.83 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA B 23 ALA.? 21.21 O1 SO4 B 1 C 126 LEU B 25 LEU.? 14.25 O1 SO4 B 1 C 158 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -12.56 13.95 22.39 -11.09 14.05 21.99 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -17.85 14.16 24.50 -18.91 15.92 23.86 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA B 84 ALA~? 9.25 O1 GOL B 4 C 126 LEU B 87 LEU~? -3.96 O1 GOL B 4s C 158 GLU B 57 GLU~? -4.12 O3 GOL B 4s coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -28.95 15.14 11.85 -27.97 14.08 11.34 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -28.62 19.24 12.63 -27.80 19.11 14.61 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -25.78 25.15 16.73 -26.80 26.19 18.23 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 C 70 ALA B 91 ALA~? -4.17 C1 GOL B 4s C 126 LEU B 87 LEU~? -3.96 O1 GOL B 4s C 158 GLU B 86 GLU~? 9.00 O1 GOL B 4 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -28.47 25.43 9.73 -27.26 24.61 9.42 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -28.62 19.24 12.63 -27.80 19.11 14.61 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -35.32 17.29 11.75 -36.56 18.30 10.39 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 5 hits 1pjh_c02 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN A 71 GLN~? -6.06 O2 GOL A 2s 294 GLU A 78 GLU.? 14.22 O2 GOL B 3 304 ARG A 70 ARG.? 9.89 O2 GOL A 2s coo 15.89 18.45 46.53 15.82 16.91 48.02 -15.56 17.61 -6.32 -16.46 18.34 -8.11 coo 22.84 13.44 52.91 20.84 13.18 52.38 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo 8.71 17.11 46.51 7.23 17.64 49.20 -18.90 15.15 -0.51 -21.15 17.20 -0.06 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 1 hits 1pmi_c00 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 68 ALA A 84 ALA~? 11.62 O2 GOL B 3 A 72 LEU A 87 LEU~? 10.16 O2 GOL B 3 coo 46.76 7.59 18.65 45.27 6.01 18.52 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 48.88 4.35 16.59 48.73 5.09 15.20 -13.79 33.34 3.78 -12.56 33.70 2.99 coo 53.89 6.25 15.09 52.88 7.92 14.14 -14.42 31.83 7.41 -13.85 29.77 7.64 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 68 ALA B 91 ALA~? -4.17 C1 GOL B 4s A 72 LEU B 87 LEU~? -3.96 O1 GOL B 4s coo 46.76 7.59 18.65 45.27 6.01 18.52 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 48.88 4.35 16.59 48.73 5.09 15.20 -28.47 25.43 9.73 -27.26 24.61 9.42 coo 53.89 6.25 15.09 52.88 7.92 14.14 -28.62 19.24 12.63 -27.80 19.11 14.61 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 # 3 A 67 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 68 ALA B 84 ALA~? 9.25 O1 GOL B 4 A 72 LEU B 87 LEU~? -3.96 O1 GOL B 4s coo 46.76 7.59 18.65 45.27 6.01 18.52 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 48.88 4.35 16.59 48.73 5.09 15.20 -28.95 15.14 11.85 -27.97 14.08 11.34 coo 53.89 6.25 15.09 52.88 7.92 14.14 -28.62 19.24 12.63 -27.80 19.11 14.61 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 3 hits 1q6l_c05 naa= 3 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 A 86 GLU B 57 GLU~? -4.12 O3 GOL B 4s A 143 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 170 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo -2.40 27.37 52.92 -1.22 29.09 52.71 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 1.36 26.79 49.43 3.17 26.89 50.50 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 7.24 31.80 48.14 6.27 25.92 49.70 -29.46 26.70 6.25 -26.96 24.00 2.30 1qfe_c00 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 1 hits 1qfe_c00 naa= 3 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 B 86 GLU B 57 GLU~? -4.12 O3 GOL B 4s B 143 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 170 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 13.90 37.16 5.96 12.00 36.26 6.12 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 13.52 33.69 9.79 13.20 31.83 8.88 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 7.52 28.83 11.02 13.59 28.74 9.95 -29.46 26.70 6.25 -26.96 24.00 2.30 1qfe_c01 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 1 hits 1qfe_c01 naa= 3 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 A 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 55.48 26.51 40.65 55.39 23.99 39.43 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 48.87 29.19 44.63 49.10 27.34 43.63 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 47.58 17.35 41.83 51.40 20.85 40.83 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 A 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 55.48 26.51 40.65 55.39 23.99 39.43 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 48.87 29.19 44.63 49.10 27.34 43.63 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 47.58 17.35 41.83 51.40 20.85 40.83 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c08 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c08 naa= 3 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 B 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 B 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 B 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c09 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c09 naa= 3 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 C 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 C 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 39.51 34.34 13.63 37.63 32.61 14.79 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 45.78 31.11 9.51 44.25 30.06 10.53 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 37.54 22.37 12.10 37.83 27.55 13.24 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 C 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 C 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 39.51 34.34 13.63 37.63 32.61 14.79 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 45.78 31.11 9.51 44.25 30.06 10.53 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 37.54 22.37 12.10 37.83 27.55 13.24 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c10 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c10 naa= 3 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 D 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 D 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 D 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 D 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c11 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c11 naa= 3 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 E 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 E 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 E 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 E 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c12 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c12 naa= 3 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 F 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 F 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 F 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 F 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c13 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c13 naa= 3 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 G 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 G 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 G 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 G 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c14 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c14 naa= 3 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 163 TYR A 56 TYR~? 21.37 C3 GOL A 2 H 236 ASP A 60 ASP~? 16.34 O3 GOL A 2 H 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 163 TYR B 56 TYR~? 10.55 O3 GOL B 4 H 236 ASP B 60 ASP~? 9.78 O3 GOL B 4 H 261 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 -9.77 24.33 22.44 -10.89 19.77 26.71 1qgn_c15 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c15 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG B 21 ARG.? 13.55 O3 GOL B 4 C 163 TYR B 15 TYR.? 18.41 O3 GOL B 4 C 236 ASP A 50 ASP~? 20.38 O1 GOL B 3 coo 39.01 29.77 22.02 37.48 31.30 19.84 -14.41 22.89 22.20 -17.07 24.46 22.16 coo 39.51 34.34 13.63 37.63 32.61 14.79 -9.10 28.01 20.14 -10.98 27.06 18.31 coo 45.78 31.11 9.51 44.25 30.06 10.53 -8.90 35.05 16.33 -9.12 35.63 18.37 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR B 15 TYR.? 18.41 O3 GOL B 4 A 236 ASP A 50 ASP~? 20.38 O1 GOL B 3 C 110 ARG B 21 ARG.? 13.55 O3 GOL B 4 coo 55.48 26.51 40.65 55.39 23.99 39.43 -9.10 28.01 20.14 -10.98 27.06 18.31 coo 48.87 29.19 44.63 49.10 27.34 43.63 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 52.39 23.42 32.10 54.51 23.27 34.29 -14.41 22.89 22.20 -17.07 24.46 22.16 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 B 15 TYR.? 18.41 O3 GOL B 4 B 236 ASP A 50 ASP~? 20.38 O1 GOL B 3 D 110 ARG B 21 ARG.? 13.55 O3 GOL B 4 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -9.10 28.01 20.14 -10.98 27.06 18.31 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -14.41 22.89 22.20 -17.07 24.46 22.16 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 B 21 ARG.? 13.55 O3 GOL B 4 G 163 TYR B 15 TYR.? 18.41 O3 GOL B 4 G 236 ASP A 50 ASP~? 20.38 O1 GOL B 3 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 -14.41 22.89 22.20 -17.07 24.46 22.16 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -9.10 28.01 20.14 -10.98 27.06 18.31 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -8.90 35.05 16.33 -9.12 35.63 18.37 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR B 15 TYR.? 18.41 O3 GOL B 4 E 236 ASP A 50 ASP~? 20.38 O1 GOL B 3 G 110 ARG B 21 ARG.? 13.55 O3 GOL B 4 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -9.10 28.01 20.14 -10.98 27.06 18.31 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -14.41 22.89 22.20 -17.07 24.46 22.16 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 B 15 TYR.? 18.41 O3 GOL B 4 F 236 ASP A 50 ASP~? 20.38 O1 GOL B 3 H 110 ARG B 21 ARG.? 13.55 O3 GOL B 4 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -9.10 28.01 20.14 -10.98 27.06 18.31 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 -14.41 22.89 22.20 -17.07 24.46 22.16 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c23 naa= 3 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 # 1 A 49 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 147 THR A 76 THR~? 10.21 O2 GOL B 3 A 294 ASP A 28 ASP~? -5.64 O1 GOL A 2s coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -16.80 26.53 0.10 -14.78 26.55 -0.66 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -8.78 21.17 -6.27 -8.56 20.83 -8.37 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 # 2 A 49 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 147 THR A 76 THR~? 10.21 O2 GOL B 3 A 294 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -16.80 26.53 0.10 -14.78 26.55 -0.66 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 # 3 A 49 ASP B 74 ASP~? -3.22 O1 SO4 B 1s A 147 THR B 76 THR~? 11.27 O1 SO4 B 1 A 294 ASP B 60 ASP~? 9.78 O3 GOL B 4 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -30.92 13.53 20.08 -29.12 12.38 19.81 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -23.30 24.41 22.44 -21.92 26.02 22.10 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 # 4 A 49 ASP B 79 ASP~? 15.24 O1 GOL B 4 A 147 THR B 76 THR~? 11.27 O1 SO4 B 1 A 294 ASP B 28 ASP~? 10.74 O1 SO4 B 1 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -30.92 13.53 20.08 -29.12 12.38 19.81 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -22.51 7.08 24.60 -22.34 5.01 25.19 1qgx_c02 source 1qgx 3',5'-ADENOSINE BISPHOSPHATASE : 4 hits 1qgx_c02 naa= 3 ULMN 3 1qho_c04 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 256 GLU B 86 GLU~? 9.00 O1 GOL B 4 A 329 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 28.46 69.88 26.74 30.40 70.70 26.53 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 30.54 71.65 32.58 31.73 72.26 30.92 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 37.87 70.12 31.80 36.61 69.74 30.15 -34.62 8.62 14.62 -34.31 8.46 12.53 1qho_c04 source 1qho ALPHA-AMYLASE : 1 hits 1qho_c04 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 28 ASP~? -5.64 O1 GOL A 2s A 261 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 329 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 28.46 69.88 26.74 30.40 70.70 26.53 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 34.02 79.89 42.60 34.73 78.01 41.86 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 37.87 70.12 31.80 36.61 69.74 30.15 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 261 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 329 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 28.46 69.88 26.74 30.40 70.70 26.53 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 34.02 79.89 42.60 34.73 78.01 41.86 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 37.87 70.12 31.80 36.61 69.74 30.15 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1qho_c05 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 261 ASP A 28 ASP~? -5.64 O1 GOL A 2s A 329 ASP A 79 ASP~? 10.37 O2 GOL B 3 coo 28.46 69.88 26.74 30.40 70.70 26.53 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 34.02 79.89 42.60 34.73 78.01 41.86 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 37.87 70.12 31.80 36.61 69.74 30.15 -18.83 33.10 -3.96 -18.26 35.08 -3.55 ULMN 3 1qho_c05 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 261 ASP B 28 ASP~? 10.74 O1 SO4 B 1 A 329 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 28.46 69.88 26.74 30.40 70.70 26.53 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 34.02 79.89 42.60 34.73 78.01 41.86 -22.51 7.08 24.60 -22.34 5.01 25.19 coo 37.87 70.12 31.80 36.61 69.74 30.15 -34.62 8.62 14.62 -34.31 8.46 12.53 ULMN 3 1qho_c05 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 261 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 329 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 28.46 69.88 26.74 30.40 70.70 26.53 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 34.02 79.89 42.60 34.73 78.01 41.86 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 37.87 70.12 31.80 36.61 69.74 30.15 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1qho_c05 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 261 ASP B 74 ASP~? -3.22 O1 SO4 B 1s A 329 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 28.46 69.88 26.74 30.40 70.70 26.53 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 34.02 79.89 42.60 34.73 78.01 41.86 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 37.87 70.12 31.80 36.61 69.74 30.15 -34.62 8.62 14.62 -34.31 8.46 12.53 1qho_c05 source 1qho ALPHA-AMYLASE : 6 hits 1qho_c05 naa= 3 ULMN 3 1qho_c07 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 28 ASP~? -5.64 O1 GOL A 2s A 260 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 329 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 28.46 69.88 26.74 30.40 70.70 26.53 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 30.73 81.29 37.61 31.23 82.07 35.69 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 37.87 70.12 31.80 36.61 69.74 30.15 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1qho_c07 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 28 ASP~? -5.64 O1 GOL A 2s A 260 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 329 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 28.46 69.88 26.74 30.40 70.70 26.53 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 30.73 81.29 37.61 31.23 82.07 35.69 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 37.87 70.12 31.80 36.61 69.74 30.15 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1qho_c07 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 260 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 329 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 28.46 69.88 26.74 30.40 70.70 26.53 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 30.73 81.29 37.61 31.23 82.07 35.69 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 37.87 70.12 31.80 36.61 69.74 30.15 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1qho_c07 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 260 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 329 ASP A 85 ASP~? 11.55 O1 GOL B 3 coo 28.46 69.88 26.74 30.40 70.70 26.53 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 30.73 81.29 37.61 31.23 82.07 35.69 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 37.87 70.12 31.80 36.61 69.74 30.15 -16.43 37.33 3.51 -16.88 39.23 4.17 ULMN 3 1qho_c07 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 260 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 329 ASP A 79 ASP~? 10.37 O2 GOL B 3 coo 28.46 69.88 26.74 30.40 70.70 26.53 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 30.73 81.29 37.61 31.23 82.07 35.69 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 37.87 70.12 31.80 36.61 69.74 30.15 -18.83 33.10 -3.96 -18.26 35.08 -3.55 ULMN 3 1qho_c07 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP B 28 ASP~? 10.74 O1 SO4 B 1 A 260 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 329 ASP B 74 ASP~? -3.22 O1 SO4 B 1s coo 28.46 69.88 26.74 30.40 70.70 26.53 -22.51 7.08 24.60 -22.34 5.01 25.19 coo 30.73 81.29 37.61 31.23 82.07 35.69 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 37.87 70.12 31.80 36.61 69.74 30.15 -31.73 12.15 27.06 -32.07 10.54 28.42 ULMN 3 1qho_c07 ALPHA-AMYLASE user 7 3 # 7 A 228 ASP B 28 ASP~? 10.74 O1 SO4 B 1 A 260 ASP B 79 ASP~? 15.24 O1 GOL B 4 A 329 ASP B 74 ASP~? -3.22 O1 SO4 B 1s coo 28.46 69.88 26.74 30.40 70.70 26.53 -22.51 7.08 24.60 -22.34 5.01 25.19 coo 30.73 81.29 37.61 31.23 82.07 35.69 -34.62 8.62 14.62 -34.31 8.46 12.53 coo 37.87 70.12 31.80 36.61 69.74 30.15 -31.73 12.15 27.06 -32.07 10.54 28.42 ULMN 3 1qho_c07 ALPHA-AMYLASE user 8 3 # 8 A 228 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 260 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 329 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 28.46 69.88 26.74 30.40 70.70 26.53 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 30.73 81.29 37.61 31.23 82.07 35.69 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 37.87 70.12 31.80 36.61 69.74 30.15 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1qho_c07 ALPHA-AMYLASE user 9 3 # 9 A 228 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 260 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 329 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 28.46 69.88 26.74 30.40 70.70 26.53 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 30.73 81.29 37.61 31.23 82.07 35.69 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 37.87 70.12 31.80 36.61 69.74 30.15 -18.93 20.14 -2.22 -19.22 19.03 -4.07 1qho_c07 source 1qho ALPHA-AMYLASE : 9 hits 1qho_c07 naa= 3 ULMN 3 1qz9_c02 KYNURENINASE user 1 3 # 1 A 129 PHE A 43 PHE~? 17.67 O2 GOL B 3 A 201 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 227 LYS A 34 LYS~? 16.07 O1 GOL A 2 coo 23.39 49.81 32.16 21.33 51.68 32.26 -10.55 41.39 3.11 -10.71 42.10 0.46 coo 25.52 45.12 37.98 23.98 46.65 37.85 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 12.68 46.83 36.69 18.26 48.67 34.51 -4.31 29.33 -0.01 -0.74 29.76 -4.84 ULMN 3 1qz9_c02 KYNURENINASE user 2 3 # 2 A 129 PHE A 43 PHE~? 17.67 O2 GOL B 3 A 201 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 227 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 23.39 49.81 32.16 21.33 51.68 32.26 -10.55 41.39 3.11 -10.71 42.10 0.46 coo 25.52 45.12 37.98 23.98 46.65 37.85 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 12.68 46.83 36.69 18.26 48.67 34.51 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1qz9_c02 KYNURENINASE user 3 3 # 3 A 129 PHE A 83 PHE~? 7.77 O2 GOL B 3 A 201 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 227 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 23.39 49.81 32.16 21.33 51.68 32.26 -16.08 29.46 2.61 -15.52 27.45 4.47 coo 25.52 45.12 37.98 23.98 46.65 37.85 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 12.68 46.83 36.69 18.26 48.67 34.51 -7.03 31.61 -1.42 -10.99 31.33 -6.00 ULMN 3 1qz9_c02 KYNURENINASE user 4 3 # 4 A 129 PHE A 83 PHE~? 7.77 O2 GOL B 3 A 201 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 227 LYS A 34 LYS~? 16.07 O1 GOL A 2 coo 23.39 49.81 32.16 21.33 51.68 32.26 -16.08 29.46 2.61 -15.52 27.45 4.47 coo 25.52 45.12 37.98 23.98 46.65 37.85 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 12.68 46.83 36.69 18.26 48.67 34.51 -4.31 29.33 -0.01 -0.74 29.76 -4.84 ULMN 3 1qz9_c02 KYNURENINASE user 5 3 # 5 A 129 PHE A 83 PHE~? 7.77 O2 GOL B 3 A 201 ASP A 85 ASP~? 11.55 O1 GOL B 3 A 227 LYS A 35 LYS~? 14.51 O1 GOL A 2 coo 23.39 49.81 32.16 21.33 51.68 32.26 -16.08 29.46 2.61 -15.52 27.45 4.47 coo 25.52 45.12 37.98 23.98 46.65 37.85 -16.43 37.33 3.51 -16.88 39.23 4.17 coo 12.68 46.83 36.69 18.26 48.67 34.51 -7.03 31.61 -1.42 -10.99 31.33 -6.00 1qz9_c02 source 1qz9 KYNURENINASE : 5 hits 1qz9_c02 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 186 ASN B 90 ASN~? -3.47 O2 GOL B 4s A 260 ALA B 84 ALA~? 9.25 O1 GOL B 4 coo 11.81 33.10 11.71 13.07 31.45 11.40 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 11.43 26.53 7.41 13.01 27.56 8.43 -32.17 23.75 11.87 -32.87 25.37 13.10 coo 21.53 26.33 6.96 20.26 25.69 7.52 -28.95 15.14 11.85 -27.97 14.08 11.34 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 1 hits 1r4f_c00 naa= 3 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 A 137 GLU A 14 GLU~? -24.52 O3 GOL A 2s A 288 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 329 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 29.27 18.78 14.99 27.16 18.62 14.76 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 49.52 10.06 10.36 50.99 9.65 8.92 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 57.80 12.92 13.83 53.77 8.42 12.15 -29.46 26.70 6.25 -26.96 24.00 2.30 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 A 137 GLU B 14 GLU.? 23.95 O3 GOL B 4 A 288 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 329 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 29.27 18.78 14.99 27.16 18.62 14.76 -6.12 30.69 25.05 -7.11 32.53 25.27 coo 49.52 10.06 10.36 50.99 9.65 8.92 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 57.80 12.92 13.83 53.77 8.42 12.15 -29.46 26.70 6.25 -26.96 24.00 2.30 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 3 3 # 3 A 137 GLU B 68 GLU.? 10.02 O4 SO4 B 1 A 288 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 329 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 29.27 18.78 14.99 27.16 18.62 14.76 -26.98 18.86 32.35 -27.81 20.20 33.71 coo 49.52 10.06 10.36 50.99 9.65 8.92 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 57.80 12.92 13.83 53.77 8.42 12.15 -29.46 26.70 6.25 -26.96 24.00 2.30 1roz_c00 source 1roz DEOXYHYPUSINE SYNTHASE : 3 hits 1roz_c00 naa= 3 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 B 137 GLU A 14 GLU~? -24.52 O3 GOL A 2s B 288 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 329 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 -29.46 26.70 6.25 -26.96 24.00 2.30 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 B 137 GLU B 14 GLU.? 23.95 O3 GOL B 4 B 288 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 329 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 -6.12 30.69 25.05 -7.11 32.53 25.27 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 -29.46 26.70 6.25 -26.96 24.00 2.30 1roz_c01 source 1roz DEOXYHYPUSINE SYNTHASE : 2 hits 1roz_c01 naa= 3 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 # 1 A 104 ILE A 54 ILE~? 14.70 O1 GOL B 3 A 106 HIS A 53 HIS~? 22.15 O3 GOL B 4 A 142 ASP A 50 ASP~? 20.38 O1 GOL B 3 coo -15.54 60.72 29.56 -16.71 61.53 30.10 -10.62 30.73 11.83 -11.53 31.74 11.69 coo -17.00 64.03 23.46 -18.21 65.65 22.90 -6.79 29.31 17.48 -5.37 29.37 19.01 coo -17.05 67.91 26.85 -18.66 66.47 26.76 -8.90 35.05 16.33 -9.12 35.63 18.37 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 2 3 # 2 A 104 ILE B 54 ILE~? 4.89 C1 GOL B 4 A 106 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 142 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo -15.54 60.72 29.56 -16.71 61.53 30.10 -24.21 21.45 12.18 -25.06 20.70 11.48 coo -17.00 64.03 23.46 -18.21 65.65 22.90 -23.08 27.98 11.02 -22.64 29.79 10.05 coo -17.05 67.91 26.85 -18.66 66.47 26.76 -24.34 23.91 6.60 -25.45 25.08 5.29 1s3i_c00 source 1s3i 10-FORMYLTETRAHYDROFOLATE DEHYDROGENASE : 2 hits 1s3i_c00 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 50 ASP~? 20.38 O1 GOL B 3 595 GLU A 57 GLU~? 16.18 C3 GOL B 4 713 TYR A 56 TYR~? 21.37 C3 GOL A 2 coo 5.64 2.82 38.49 4.59 4.19 37.25 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 4.35 13.73 37.63 3.39 12.18 36.55 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 3.76 10.25 31.38 3.16 9.87 34.10 -4.76 25.74 13.22 -2.26 27.02 13.36 ULMN 3 1sll_c00 SIALIDASE L user 2 3 # 2 318 ASP B 50 ASP~? -2.86 O3 GOL B 3s 595 GLU B 57 GLU~? -4.12 O3 GOL B 4s 713 TYR B 56 TYR~? 10.55 O3 GOL B 4 coo 5.64 2.82 38.49 4.59 4.19 37.25 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 4.35 13.73 37.63 3.39 12.18 36.55 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 3.76 10.25 31.38 3.16 9.87 34.10 -18.76 26.04 16.25 -16.06 26.60 15.60 1sll_c00 source 1sll SIALIDASE L : 2 hits 1sll_c00 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA B 45 ALA.? -8.70 O3 GOL B 3s A 251 GLY B 46 GLY.? 6.70 O3 GOL B 3 A 252 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -27.02 19.29 1.20 -28.28 19.86 0.63 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -24.88 21.02 3.88 -24.62 20.77 3.13 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -24.34 23.91 6.60 -25.45 25.08 5.29 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 1 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA B 45 ALA.? -8.70 O3 GOL B 3s B 251 GLY B 46 GLY.? 6.70 O3 GOL B 3 B 252 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -27.02 19.29 1.20 -28.28 19.86 0.63 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -24.88 21.02 3.88 -24.62 20.77 3.13 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -24.34 23.91 6.60 -25.45 25.08 5.29 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 1 hits 1tz3_c03 naa= 3 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP B 85 ASP~? 11.13 O1 GOL B 4 255 GLU B 86 GLU~? 9.00 O1 GOL B 4 329 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 49.16 35.16 15.19 51.08 34.43 15.65 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 52.57 37.12 10.17 53.37 35.95 11.75 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 59.16 37.82 13.95 57.63 37.03 15.12 -34.62 8.62 14.62 -34.31 8.46 12.53 1uok_c03 source 1uok OLIGO-1,6-GLUCOSIDASE : 1 hits 1uok_c03 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 28 ASP~? -5.64 O1 GOL A 2s 218 GLU B 63 GLU~? 15.70 C2 GOL B 4 329 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 49.16 35.16 15.19 51.08 34.43 15.65 -8.78 21.17 -6.27 -8.56 20.83 -8.37 coo 70.09 11.71 8.46 70.56 12.89 6.77 -18.99 20.23 25.46 -17.68 21.89 25.23 coo 59.16 37.82 13.95 57.63 37.03 15.12 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 74 ASP~? -7.66 O2 GOL A 2s 218 GLU B 14 GLU.? 23.95 O3 GOL B 4 329 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 49.16 35.16 15.19 51.08 34.43 15.65 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 70.09 11.71 8.46 70.56 12.89 6.77 -6.12 30.69 25.05 -7.11 32.53 25.27 coo 59.16 37.82 13.95 57.63 37.03 15.12 -24.34 23.91 6.60 -25.45 25.08 5.29 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 79 ASP~? 10.37 O2 GOL B 3 218 GLU B 63 GLU~? 15.70 C2 GOL B 4 329 ASP A 85 ASP~? 11.55 O1 GOL B 3 coo 49.16 35.16 15.19 51.08 34.43 15.65 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 70.09 11.71 8.46 70.56 12.89 6.77 -18.99 20.23 25.46 -17.68 21.89 25.23 coo 59.16 37.82 13.95 57.63 37.03 15.12 -16.43 37.33 3.51 -16.88 39.23 4.17 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP B 74 ASP~? -3.22 O1 SO4 B 1s 218 GLU B 14 GLU.? 23.95 O3 GOL B 4 329 ASP B 28 ASP~? 10.74 O1 SO4 B 1 coo 49.16 35.16 15.19 51.08 34.43 15.65 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 70.09 11.71 8.46 70.56 12.89 6.77 -6.12 30.69 25.05 -7.11 32.53 25.27 coo 59.16 37.82 13.95 57.63 37.03 15.12 -22.51 7.08 24.60 -22.34 5.01 25.19 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 4 hits 1uok_c04 naa= 3 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 74 ASP~? -7.66 O2 GOL A 2s 242 GLU B 57 GLU~? -4.12 O3 GOL B 4s 329 ASP A 28 ASP~? -5.64 O1 GOL A 2s coo 49.16 35.16 15.19 51.08 34.43 15.65 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo 30.42 34.74 5.00 29.09 35.09 3.38 -25.78 25.15 16.73 -26.80 26.19 18.23 coo 59.16 37.82 13.95 57.63 37.03 15.12 -8.78 21.17 -6.27 -8.56 20.83 -8.37 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP B 85 ASP~? 11.13 O1 GOL B 4 242 GLU A 86 GLU~? -2.98 O1 GOL B 3s 329 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 49.16 35.16 15.19 51.08 34.43 15.65 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 30.42 34.74 5.00 29.09 35.09 3.38 -20.52 33.51 6.85 -21.94 32.18 6.04 coo 59.16 37.82 13.95 57.63 37.03 15.12 -34.62 8.62 14.62 -34.31 8.46 12.53 1uok_c05 source 1uok OLIGO-1,6-GLUCOSIDASE : 2 hits 1uok_c05 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 56 TYR~? 21.37 C3 GOL A 2 A 317 GLU A 14 GLU~? -24.52 O3 GOL A 2s A 365 ARG B 21 ARG.? 13.55 O3 GOL B 4 coo 1.77 6.56 57.05 3.05 7.44 59.37 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 3.06 2.85 52.79 4.83 3.89 53.24 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 3.82 17.09 49.56 4.09 14.32 50.84 -14.41 22.89 22.20 -17.07 24.46 22.16 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 56 TYR~? 21.37 C3 GOL A 2 B1317 GLU A 14 GLU~? -24.52 O3 GOL A 2s B1365 ARG B 21 ARG.? 13.55 O3 GOL B 4 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 -14.41 22.89 22.20 -17.07 24.46 22.16 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 56 TYR~? 21.37 C3 GOL A 2 A 40 ASP A 50 ASP~? 20.38 O1 GOL B 3 A 103 LEU A 52 LEU~? 22.97 O2 GOL B 3 coo 12.09 16.13 10.57 11.28 18.80 10.73 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 7.55 25.51 14.34 9.65 25.73 14.24 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 11.83 18.73 16.99 10.99 19.71 15.26 -3.59 30.93 13.59 -1.64 31.39 12.76 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR B 39 TYR~? 12.50 O1 GOL B 4 A 40 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 103 LEU B 87 LEU~? -3.96 O1 GOL B 4s coo 12.09 16.13 10.57 11.28 18.80 10.73 -26.88 11.91 8.14 -29.28 12.36 6.79 coo 7.55 25.51 14.34 9.65 25.73 14.24 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 11.83 18.73 16.99 10.99 19.71 15.26 -28.62 19.24 12.63 -27.80 19.11 14.61 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR B 56 TYR~? 10.55 O3 GOL B 4 A 40 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 103 LEU B 52 LEU~? 9.29 C1 GOL B 3 coo 12.09 16.13 10.57 11.28 18.80 10.73 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 7.55 25.51 14.34 9.65 25.73 14.24 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 11.83 18.73 16.99 10.99 19.71 15.26 -18.30 25.52 10.44 -16.19 25.46 9.84 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR B 56 TYR~? 10.55 O3 GOL B 4 A 40 ASP B 50 ASP~? -2.86 O3 GOL B 3s A 103 LEU B 52 LEU~? 9.29 C1 GOL B 3 coo 12.09 16.13 10.57 11.28 18.80 10.73 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 7.55 25.51 14.34 9.65 25.73 14.24 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 11.83 18.73 16.99 10.99 19.71 15.26 -18.30 25.52 10.44 -16.19 25.46 9.84 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 56 TYR~? 21.37 C3 GOL A 2 B 40 ASP A 50 ASP~? 20.38 O1 GOL B 3 B 103 LEU A 52 LEU~? 22.97 O2 GOL B 3 coo 14.25 20.09 37.35 13.48 17.40 37.38 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 9.39 10.77 34.53 11.50 10.63 34.41 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 12.89 17.60 31.13 12.34 16.51 32.90 -3.59 30.93 13.59 -1.64 31.39 12.76 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR B 39 TYR~? 12.50 O1 GOL B 4 B 40 ASP B 50 ASP~? -2.86 O3 GOL B 3s B 103 LEU B 87 LEU~? -3.96 O1 GOL B 4s coo 14.25 20.09 37.35 13.48 17.40 37.38 -26.88 11.91 8.14 -29.28 12.36 6.79 coo 9.39 10.77 34.53 11.50 10.63 34.41 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 12.89 17.60 31.13 12.34 16.51 32.90 -28.62 19.24 12.63 -27.80 19.11 14.61 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR B 56 TYR~? 10.55 O3 GOL B 4 B 40 ASP A 60 ASP~? 16.34 O3 GOL A 2 B 103 LEU B 52 LEU~? 9.29 C1 GOL B 3 coo 14.25 20.09 37.35 13.48 17.40 37.38 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 9.39 10.77 34.53 11.50 10.63 34.41 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 12.89 17.60 31.13 12.34 16.51 32.90 -18.30 25.52 10.44 -16.19 25.46 9.84 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR B 56 TYR~? 10.55 O3 GOL B 4 B 40 ASP B 50 ASP~? -2.86 O3 GOL B 3s B 103 LEU B 52 LEU~? 9.29 C1 GOL B 3 coo 14.25 20.09 37.35 13.48 17.40 37.38 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 9.39 10.77 34.53 11.50 10.63 34.41 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 12.89 17.60 31.13 12.34 16.51 32.90 -18.30 25.52 10.44 -16.19 25.46 9.84 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 53 HIS~? 22.15 O3 GOL B 4 A 169 ASP A 60 ASP~? 16.34 O3 GOL A 2 A 288 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 67.72 35.99 30.87 69.77 36.13 31.33 -6.79 29.31 17.48 -5.37 29.37 19.01 coo 73.17 30.66 22.56 72.87 30.30 20.46 -10.35 19.90 11.39 -8.96 19.35 12.87 coo 74.06 28.51 15.92 73.77 29.56 17.73 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 2 3 # 2 A 105 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 169 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 288 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 67.72 35.99 30.87 69.77 36.13 31.33 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 73.17 30.66 22.56 72.87 30.30 20.46 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 74.06 28.51 15.92 73.77 29.56 17.73 -18.99 20.23 25.46 -17.68 21.89 25.23 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 2 hits 1w1o_c00 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 64 ALA~? 10.51 O3 GOL A 2 B 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s B 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 2.11 4.00 19.31 3.14 4.86 19.99 -12.48 15.28 6.50 -13.49 15.72 7.59 coo 2.45 5.53 11.28 3.59 7.56 13.29 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 6.10 2.00 25.24 6.12 1.84 23.13 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 66 ALA~? -4.16 O3 GOL A 2s B 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s B 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 2.11 4.00 19.31 3.14 4.86 19.99 -11.18 15.09 1.17 -9.76 15.59 1.18 coo 2.45 5.53 11.28 3.59 7.56 13.29 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 6.10 2.00 25.24 6.12 1.84 23.13 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 B 124 ALA A 67 ALA~? 7.17 O3 GOL A 2 B 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s B 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 2.11 4.00 19.31 3.14 4.86 19.99 -11.26 11.84 3.16 -11.02 11.64 4.67 coo 2.45 5.53 11.28 3.59 7.56 13.29 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 6.10 2.00 25.24 6.12 1.84 23.13 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 B 124 ALA B 64 ALA~? 12.60 O1 SO4 B 1 B 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s B 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 2.11 4.00 19.31 3.14 4.86 19.99 -24.36 20.54 28.36 -25.43 21.44 27.83 coo 2.45 5.53 11.28 3.59 7.56 13.29 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 6.10 2.00 25.24 6.12 1.84 23.13 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 B 124 ALA B 66 ALA~? 10.36 O1 SO4 B 1 B 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s B 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 2.11 4.00 19.31 3.14 4.86 19.99 -22.61 15.40 29.42 -21.33 15.35 28.67 coo 2.45 5.53 11.28 3.59 7.56 13.29 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 6.10 2.00 25.24 6.12 1.84 23.13 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 B 124 ALA B 67 ALA~? 12.29 O4 SO4 B 1 B 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s B 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 2.11 4.00 19.31 3.14 4.86 19.99 -22.11 17.99 32.20 -22.02 19.44 32.03 coo 2.45 5.53 11.28 3.59 7.56 13.29 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 6.10 2.00 25.24 6.12 1.84 23.13 -18.99 20.23 25.46 -17.68 21.89 25.23 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 64 ALA~? 10.51 O3 GOL A 2 C 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s C 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -12.48 15.28 6.50 -13.49 15.72 7.59 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 66 ALA~? -4.16 O3 GOL A 2s C 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s C 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -11.18 15.09 1.17 -9.76 15.59 1.18 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA A 67 ALA~? 7.17 O3 GOL A 2 C 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s C 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -11.26 11.84 3.16 -11.02 11.64 4.67 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 C 124 ALA B 64 ALA~? 12.60 O1 SO4 B 1 C 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s C 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -24.36 20.54 28.36 -25.43 21.44 27.83 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 C 124 ALA B 66 ALA~? 10.36 O1 SO4 B 1 C 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s C 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -22.61 15.40 29.42 -21.33 15.35 28.67 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 C 124 ALA B 67 ALA~? 12.29 O4 SO4 B 1 C 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s C 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -22.11 17.99 32.20 -22.02 19.44 32.03 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -18.99 20.23 25.46 -17.68 21.89 25.23 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 64 ALA~? 10.51 O3 GOL A 2 D 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s D 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -12.48 15.28 6.50 -13.49 15.72 7.59 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 6.23 0.50 57.10 5.93 0.72 59.19 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 66 ALA~? -4.16 O3 GOL A 2s D 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s D 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -11.18 15.09 1.17 -9.76 15.59 1.18 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 6.23 0.50 57.10 5.93 0.72 59.19 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA A 67 ALA~? 7.17 O3 GOL A 2 D 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s D 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -11.26 11.84 3.16 -11.02 11.64 4.67 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo 6.23 0.50 57.10 5.93 0.72 59.19 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 D 124 ALA B 64 ALA~? 12.60 O1 SO4 B 1 D 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s D 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -24.36 20.54 28.36 -25.43 21.44 27.83 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 6.23 0.50 57.10 5.93 0.72 59.19 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 D 124 ALA B 66 ALA~? 10.36 O1 SO4 B 1 D 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s D 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -22.61 15.40 29.42 -21.33 15.35 28.67 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 6.23 0.50 57.10 5.93 0.72 59.19 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 D 124 ALA B 67 ALA~? 12.29 O4 SO4 B 1 D 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s D 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -22.11 17.99 32.20 -22.02 19.44 32.03 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 6.23 0.50 57.10 5.93 0.72 59.19 -18.99 20.23 25.46 -17.68 21.89 25.23 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 64 ALA~? 10.51 O3 GOL A 2 E 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s E 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -12.48 15.28 6.50 -13.49 15.72 7.59 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 66 ALA~? -4.16 O3 GOL A 2s E 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s E 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -11.18 15.09 1.17 -9.76 15.59 1.18 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA A 67 ALA~? 7.17 O3 GOL A 2 E 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s E 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -11.26 11.84 3.16 -11.02 11.64 4.67 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 E 124 ALA B 64 ALA~? 12.60 O1 SO4 B 1 E 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s E 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -24.36 20.54 28.36 -25.43 21.44 27.83 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 E 124 ALA B 66 ALA~? 10.36 O1 SO4 B 1 E 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s E 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -22.61 15.40 29.42 -21.33 15.35 28.67 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 E 124 ALA B 67 ALA~? 12.29 O4 SO4 B 1 E 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s E 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -22.11 17.99 32.20 -22.02 19.44 32.03 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -18.99 20.23 25.46 -17.68 21.89 25.23 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 64 ALA~? 10.51 O3 GOL A 2 F 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s F 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -12.48 15.28 6.50 -13.49 15.72 7.59 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 66 ALA~? -4.16 O3 GOL A 2s F 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s F 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -11.18 15.09 1.17 -9.76 15.59 1.18 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA A 67 ALA~? 7.17 O3 GOL A 2 F 126 ARG A 70 ARG.? 9.89 O2 GOL A 2s F 138 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -11.26 11.84 3.16 -11.02 11.64 4.67 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -18.90 15.15 -0.51 -21.15 17.20 -0.06 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -6.94 17.09 6.76 -5.68 16.32 8.28 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 F 124 ALA B 64 ALA~? 12.60 O1 SO4 B 1 F 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s F 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -24.36 20.54 28.36 -25.43 21.44 27.83 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 F 124 ALA B 66 ALA~? 10.36 O1 SO4 B 1 F 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s F 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -22.61 15.40 29.42 -21.33 15.35 28.67 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -18.99 20.23 25.46 -17.68 21.89 25.23 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 F 124 ALA B 67 ALA~? 12.29 O4 SO4 B 1 F 126 ARG B 70 ARG.? -4.45 O4 SO4 B 1s F 138 GLU B 63 GLU~? 15.70 C2 GOL B 4 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -22.11 17.99 32.20 -22.02 19.44 32.03 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -30.52 14.69 29.44 -32.66 14.13 31.60 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -18.99 20.23 25.46 -17.68 21.89 25.23 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 6 hits 1xs1_c11 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY A 13 GLY~? 26.02 O3 GOL A 2 B 175 ARG A 21 ARG~? 15.66 O3 GOL A 2 B 242 TYR A 56 TYR~? 21.37 C3 GOL A 2 coo 99.45 58.28 3.33 99.57 58.61 4.10 5.48 23.17 15.70 5.34 23.31 14.85 coo 106.37 63.53 0.89 108.02 63.40 -1.62 -2.39 18.19 10.15 -5.10 18.35 11.53 coo 100.93 69.04 4.38 99.52 68.48 2.09 -4.76 25.74 13.22 -2.26 27.02 13.36 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 # 2 B 137 GLY B 69 GLY.? 6.43 O4 SO4 B 1 B 175 ARG B 70 ARG.? -4.45 O4 SO4 B 1s B 242 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 99.45 58.28 3.33 99.57 58.61 4.10 -24.66 13.34 33.36 -25.24 13.72 32.93 coo 106.37 63.53 0.89 108.02 63.40 -1.62 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 100.93 69.04 4.38 99.52 68.48 2.09 -22.35 12.75 24.72 -24.49 13.46 26.40 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 3 3 # 3 B 137 GLY B 77 GLY~? 11.15 O1 SO4 B 1 B 175 ARG B 70 ARG.? -4.45 O4 SO4 B 1s B 242 TYR B 29 TYR~? 8.93 O1 SO4 B 1 coo 99.45 58.28 3.33 99.57 58.61 4.10 -33.80 11.09 20.38 -32.97 10.98 20.23 coo 106.37 63.53 0.89 108.02 63.40 -1.62 -30.52 14.69 29.44 -32.66 14.13 31.60 coo 100.93 69.04 4.38 99.52 68.48 2.09 -22.35 12.75 24.72 -24.49 13.46 26.40 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 41 TRP~? 22.51 O2 GOL B 3 223 ASP A 50 ASP~? 20.38 O1 GOL B 3 258 ALA A 84 ALA~? 11.62 O2 GOL B 3 coo 128.40 33.01 26.67 128.12 36.28 28.81 -2.93 36.21 7.51 -0.60 33.79 5.48 coo 127.91 41.73 23.55 129.18 40.35 24.44 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 141.00 37.49 25.74 139.80 37.53 24.78 -13.79 33.34 3.78 -12.56 33.70 2.99 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP B 41 TRP~? 10.69 C3 GOL A 2 223 ASP B 50 ASP~? -2.86 O3 GOL B 3s 258 ALA B 81 ALA~? 14.21 O1 GOL B 4 coo 128.40 33.01 26.67 128.12 36.28 28.81 -18.06 14.73 6.95 -16.81 17.82 4.85 coo 127.91 41.73 23.55 129.18 40.35 24.44 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 141.00 37.49 25.74 139.80 37.53 24.78 -30.16 10.32 11.26 -30.40 9.10 10.32 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 2 hits 2aat_c01 naa= 3 ULMN 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP B 85 ASP~? 11.13 O1 GOL B 4 219 GLU B 86 GLU~? 9.00 O1 GOL B 4 294 ASP B 79 ASP~? 15.24 O1 GOL B 4 coo 27.89 102.52 14.98 29.35 101.92 13.57 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 25.84 105.87 9.06 27.86 105.55 8.74 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 33.16 106.80 7.72 33.34 104.87 6.92 -34.62 8.62 14.62 -34.31 8.46 12.53 2amg_c02 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 1 hits 2amg_c02 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP B 28 ASP~? 10.74 O1 SO4 B 1 231 ASP B 50 ASP~? -2.86 O3 GOL B 3s 294 ASP B 74 ASP~? -3.22 O1 SO4 B 1s coo 27.89 102.52 14.98 29.35 101.92 13.57 -22.51 7.08 24.60 -22.34 5.01 25.19 coo 14.74 93.05 -1.00 14.30 94.22 0.73 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 33.16 106.80 7.72 33.34 104.87 6.92 -31.73 12.15 27.06 -32.07 10.54 28.42 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP B 50 ASP~? -2.86 O3 GOL B 3s 231 ASP A 50 ASP~? 20.38 O1 GOL B 3 294 ASP A 74 ASP~? -7.66 O2 GOL A 2s coo 27.89 102.52 14.98 29.35 101.92 13.57 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 14.74 93.05 -1.00 14.30 94.22 0.73 -8.90 35.05 16.33 -9.12 35.63 18.37 coo 33.16 106.80 7.72 33.34 104.87 6.92 -18.93 20.14 -2.22 -19.22 19.03 -4.07 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP B 74 ASP~? -3.22 O1 SO4 B 1s 231 ASP B 50 ASP~? -2.86 O3 GOL B 3s 294 ASP B 28 ASP~? 10.74 O1 SO4 B 1 coo 27.89 102.52 14.98 29.35 101.92 13.57 -31.73 12.15 27.06 -32.07 10.54 28.42 coo 14.74 93.05 -1.00 14.30 94.22 0.73 -24.34 23.91 6.60 -25.45 25.08 5.29 coo 33.16 106.80 7.72 33.34 104.87 6.92 -22.51 7.08 24.60 -22.34 5.01 25.19 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 3 hits 2amg_c06 naa= 3 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 1 3 # 1 A 197 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 233 GLU B 86 GLU~? 9.00 O1 GOL B 4 A 300 ASN B 90 ASN~? -3.47 O2 GOL B 4s coo 12.51 17.07 49.46 12.44 16.89 47.35 -32.24 14.59 8.46 -32.94 14.97 6.62 coo 6.52 19.14 48.16 7.77 18.42 46.61 -35.32 17.29 11.75 -36.56 18.30 10.39 coo 9.30 22.40 41.76 10.10 20.96 40.36 -32.17 23.75 11.87 -32.87 25.37 13.10 2cpu_c01 source 2cpu ALPHA-AMYLASE : 1 hits 2cpu_c01 naa= 3 ULMN 3 2dbt_c00 CHITINASE C user 1 3 # 1 A 147 GLU A 57 GLU~? 16.18 C3 GOL B 4 A 156 GLU A 14 GLU~? -24.52 O3 GOL A 2s A 194 ASN A 47 ASN~? 24.68 O1 GOL B 3 coo 74.14 15.91 8.55 72.08 15.36 8.63 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 67.47 20.07 1.34 65.99 20.06 2.88 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 67.44 25.26 13.91 67.54 23.65 15.28 -6.46 38.28 17.90 -4.81 37.72 19.05 2dbt_c00 source 2dbt CHITINASE C : 1 hits 2dbt_c00 naa= 3 ULMN 3 2dbt_c02 CHITINASE C user 1 3 # 1 C 147 GLU A 57 GLU~? 16.18 C3 GOL B 4 C 156 GLU A 14 GLU~? -24.52 O3 GOL A 2s C 194 ASN A 47 ASN~? 24.68 O1 GOL B 3 coo 41.23 29.31 13.28 43.03 29.85 12.29 -11.51 25.36 14.24 -11.92 23.60 15.35 coo 44.75 23.09 5.51 46.77 22.91 6.12 -0.60 24.22 15.96 -1.86 25.12 17.42 coo 49.75 21.00 18.12 50.45 23.02 18.26 -6.46 38.28 17.90 -4.81 37.72 19.05 2dbt_c02 source 2dbt CHITINASE C : 1 hits 2dbt_c02 naa= 3 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 157 PHE B 43 PHE~? 16.92 O2 GOL A 2 A 245 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 273 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 -26.49 10.01 3.61 -25.38 7.45 3.49 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 -32.24 14.59 8.46 -32.94 14.97 6.62 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 -29.46 26.70 6.25 -26.96 24.00 2.30 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 157 PHE B 62 PHE~? 11.64 O1 GOL B 4 A 245 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 273 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 -23.46 16.27 21.87 -24.99 14.82 20.07 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 -23.30 24.41 22.44 -21.92 26.02 22.10 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 -9.77 24.33 22.44 -10.89 19.77 26.71 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 3 3 # 3 A 157 PHE B 83 PHE~? 7.58 O1 GOL B 4 A 245 ASP B 85 ASP~? 11.13 O1 GOL B 4 A 273 LYS B 92 LYS~? 4.07 O3 GOL B 3 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 -30.58 15.06 16.28 -29.58 17.16 17.80 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 -32.24 14.59 8.46 -32.94 14.97 6.62 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 -29.46 26.70 6.25 -26.96 24.00 2.30 2gsa_c04 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 3 hits 2gsa_c04 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE B 33 PHE~? 12.08 C1 GOL B 4 A 263 ASP B 60 ASP~? 9.78 O3 GOL B 4 A 292 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 51.51 50.32 16.39 52.13 49.68 13.75 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 54.43 44.82 23.74 55.21 45.06 21.80 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 63.95 45.30 16.71 59.11 49.15 16.05 -9.77 24.33 22.44 -10.89 19.77 26.71 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c03 naa= 3 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 177 PHE B 33 PHE~? 12.08 C1 GOL B 4 B 263 ASP B 60 ASP~? 9.78 O3 GOL B 4 B 292 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 49.99 26.05 6.28 51.46 26.87 8.49 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 60.53 31.67 0.97 57.79 27.51 3.63 -9.77 24.33 22.44 -10.89 19.77 26.71 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 B 33 PHE~? 12.08 C1 GOL B 4 C 263 ASP B 60 ASP~? 9.78 O3 GOL B 4 C 292 LYS B 16 LYS.? 21.80 O1 SO4 B 1 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 -19.88 15.24 17.54 -19.22 17.82 16.72 coo 19.84 12.02 9.33 18.68 11.23 7.75 -23.30 24.41 22.44 -21.92 26.02 22.10 coo 12.82 3.49 4.98 17.80 5.59 1.90 -9.77 24.33 22.44 -10.89 19.77 26.71 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c05 naa= 3 ULMN 3 2pth_c00 PEPTIDYL-TRNA HYDROLASE user 1 3 # 1 10 ASN A 90 ASN~? 6.78 O1 GOL B 3 20 HIS B 53 HIS~? 4.97 C1 GOL B 3 93 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 45.21 45.27 48.24 46.79 44.92 46.88 -18.60 32.80 11.91 -20.33 33.24 10.71 coo 47.05 39.55 45.24 48.99 39.30 44.46 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 46.96 34.22 47.29 47.91 35.95 46.52 -24.34 23.91 6.60 -25.45 25.08 5.29 2pth_c00 source 2pth PEPTIDYL-TRNA HYDROLASE : 1 hits 2pth_c00 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP B 85 ASP~? 11.13 O1 GOL B 4 166 GLY A 65 GLY~? 6.84 C3 GOL A 2 169 GLU A 63 GLU~? 12.00 O3 GOL A 2 coo 8.28 6.87 1.62 10.08 5.77 1.34 -32.24 14.59 8.46 -32.94 14.97 6.62 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -14.11 16.35 3.28 -13.40 15.97 3.38 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -6.94 17.09 6.76 -5.68 16.32 8.28 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 56 TYR~? 21.37 C3 GOL A 2 A 172 HIS A 53 HIS~? 22.15 O3 GOL B 4 A 267 ASP A 50 ASP~? 20.38 O1 GOL B 3 coo 26.78 20.44 0.03 28.51 18.26 0.09 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 -6.79 29.31 17.48 -5.37 29.37 19.01 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 -8.90 35.05 16.33 -9.12 35.63 18.37 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 A 169 TYR B 56 TYR~? 10.55 O3 GOL B 4 A 172 HIS B 53 HIS~? 4.97 C1 GOL B 3 A 267 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 26.78 20.44 0.03 28.51 18.26 0.09 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 -24.34 23.91 6.60 -25.45 25.08 5.29 2tmd_c00 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 2 hits 2tmd_c00 naa= 3 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 B 169 TYR A 56 TYR~? 21.37 C3 GOL A 2 B 172 HIS A 53 HIS~? 22.15 O3 GOL B 4 B 267 ASP A 50 ASP~? 20.38 O1 GOL B 3 coo 44.86 1.98 33.27 42.75 1.12 31.67 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 -6.79 29.31 17.48 -5.37 29.37 19.01 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 -8.90 35.05 16.33 -9.12 35.63 18.37 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 B 169 TYR B 56 TYR~? 10.55 O3 GOL B 4 B 172 HIS B 53 HIS~? 4.97 C1 GOL B 3 B 267 ASP B 50 ASP~? -2.86 O3 GOL B 3s coo 44.86 1.98 33.27 42.75 1.12 31.67 -18.76 26.04 16.25 -16.06 26.60 15.60 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 -23.08 27.98 11.02 -22.64 29.79 10.05 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 -24.34 23.91 6.60 -25.45 25.08 5.29 2tmd_c01 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 2 hits 2tmd_c01 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 38 ASN~? 19.93 O1 GOL A 2 coo 5.80 63.03 55.85 5.52 65.03 56.45 -4.29 35.12 0.32 -2.28 34.46 0.08 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 42 ASN~? 21.28 O2 GOL B 3 coo 5.80 63.03 55.85 5.52 65.03 56.45 -6.52 40.38 2.06 -4.98 39.86 0.63 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 47 ASN~? 24.68 O1 GOL B 3 coo 5.80 63.03 55.85 5.52 65.03 56.45 -6.46 38.28 17.90 -4.81 37.72 19.05 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 90 ASN~? 6.78 O1 GOL B 3 coo 5.80 63.03 55.85 5.52 65.03 56.45 -18.60 32.80 11.91 -20.33 33.24 10.71 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 5 1 # 5 A 461 ASN B 38 ASN~? 14.67 O3 GOL A 2 coo 5.80 63.03 55.85 5.52 65.03 56.45 -20.70 9.72 9.05 -20.50 8.46 7.38 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 6 1 # 6 A 461 ASN B 42 ASN~? 11.84 O3 GOL A 2 coo 5.80 63.03 55.85 5.52 65.03 56.45 -22.46 10.42 3.33 -20.40 9.85 3.37 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 7 1 # 7 A 461 ASN B 47 ASN~? -3.34 C2 GOL B 3s coo 5.80 63.03 55.85 5.52 65.03 56.45 -22.17 24.60 2.06 -23.18 26.07 3.21 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 8 1 # 8 A 461 ASN B 90 ASN~? -3.47 O2 GOL B 4s coo 5.80 63.03 55.85 5.52 65.03 56.45 -32.17 23.75 11.87 -32.87 25.37 13.10 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 8 hits 1kbk_p00 naa= 1 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 # 1 A 270 ASN A 90 ASN~? 6.78 O1 GOL B 3 A 384 ASN B 38 ASN~? 14.67 O3 GOL A 2 A 385 GLU A 68 GLU~? 10.31 O3 GOL A 2 coo 22.28 63.17 110.61 22.47 65.06 111.53 -18.60 32.80 11.91 -20.33 33.24 10.71 coo 7.06 50.07 96.17 8.50 48.54 96.31 -20.70 9.72 9.05 -20.50 8.46 7.38 coo 11.59 49.83 99.41 10.92 47.97 100.16 -16.23 12.26 4.49 -17.05 10.50 5.25 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 # 2 A 270 ASN A 90 ASN~? 6.78 O1 GOL B 3 A 384 ASN B 42 ASN~? 11.84 O3 GOL A 2 A 385 GLU A 68 GLU~? 10.31 O3 GOL A 2 coo 22.28 63.17 110.61 22.47 65.06 111.53 -18.60 32.80 11.91 -20.33 33.24 10.71 coo 7.06 50.07 96.17 8.50 48.54 96.31 -22.46 10.42 3.33 -20.40 9.85 3.37 coo 11.59 49.83 99.41 10.92 47.97 100.16 -16.23 12.26 4.49 -17.05 10.50 5.25 2v3r_p00 source 2v3r EXOGLUCANASE 1 : 2 hits 2v3r_p00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 29 TYR~? -4.87 O1 GOL A 2s I 306 VAL A 32 VAL~? 10.12 O1 GOL A 2 I 308 VAL A 80 VAL~? 11.42 O2 GOL B 3 coo 26.18 35.24 6.87 24.33 35.18 8.97 -9.33 19.89 -0.73 -11.85 18.67 -0.31 coo 23.55 29.53 9.81 23.15 27.39 10.24 -8.57 26.99 -2.23 -10.61 26.41 -2.57 coo 16.43 30.18 9.35 15.05 30.67 11.01 -14.59 31.58 -1.98 -12.81 30.31 -2.28 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR A 39 TYR~? 14.11 O2 GOL B 3 I 306 VAL A 80 VAL~? 11.42 O2 GOL B 3 I 308 VAL A 32 VAL~? 10.12 O1 GOL A 2 coo 26.18 35.24 6.87 24.33 35.18 8.97 -10.75 36.73 1.72 -12.98 38.41 1.98 coo 23.55 29.53 9.81 23.15 27.39 10.24 -14.59 31.58 -1.98 -12.81 30.31 -2.28 coo 16.43 30.18 9.35 15.05 30.67 11.01 -8.57 26.99 -2.23 -10.61 26.41 -2.57 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 3 3 # 3 I 303 TYR B 29 TYR~? 8.93 O1 SO4 B 1 I 306 VAL B 32 VAL~? 13.60 O1 SO4 B 1 I 308 VAL B 80 VAL~? 13.16 O1 GOL B 4 coo 26.18 35.24 6.87 24.33 35.18 8.97 -22.35 12.75 24.72 -24.49 13.46 26.40 coo 23.55 29.53 9.81 23.15 27.39 10.24 -23.12 9.96 18.05 -25.09 10.01 19.03 coo 16.43 30.18 9.35 15.05 30.67 11.01 -30.01 10.14 15.08 -28.08 9.61 16.05 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 4 3 # 4 I 303 TYR B 39 TYR~? 12.50 O1 GOL B 4 I 306 VAL B 80 VAL~? 13.16 O1 GOL B 4 I 308 VAL B 32 VAL~? 13.60 O1 SO4 B 1 coo 26.18 35.24 6.87 24.33 35.18 8.97 -26.88 11.91 8.14 -29.28 12.36 6.79 coo 23.55 29.53 9.81 23.15 27.39 10.24 -30.01 10.14 15.08 -28.08 9.61 16.05 coo 16.43 30.18 9.35 15.05 30.67 11.01 -23.12 9.96 18.05 -25.09 10.01 19.03 1cqt_d00 source 1cqt GENE REGULATION/DNA : 4 hits 1cqt_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 26 PRO~? 4.58 O1 GOL A 2 A 272 LEU A 25 LEU.? 8.23 O1 GOL A 2 A 276 ARG A 21 ARG~? 15.66 O3 GOL A 2 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 -7.32 15.93 -2.51 -5.44 17.19 -2.50 coo 10.97 0.43 16.73 11.31 2.11 18.06 -5.34 18.64 0.93 -6.39 18.90 2.83 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 -2.39 18.19 10.15 -5.10 18.35 11.53 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO B 26 PRO~? 11.71 O1 SO4 B 1 A 272 LEU B 25 LEU.? 14.25 O1 SO4 B 1 A 276 ARG B 21 ARG.? 13.55 O3 GOL B 4 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 -19.57 11.76 28.44 -18.01 11.33 26.88 coo 10.97 0.43 16.73 11.31 2.11 18.06 -17.85 14.16 24.50 -18.91 15.92 23.86 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 -14.41 22.89 22.20 -17.07 24.46 22.16 1emh_d00 source 1emh HYDROLASE/DNA : 2 hits 1emh_d00 naa= 3 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 1 3 # 1 A 40 LYS A 34 LYS~? 16.07 O1 GOL A 2 A 41 LYS A 35 LYS~? 14.51 O1 GOL A 2 A 42 ILE A 36 ILE~? 13.49 O2 GOL B 3 coo 36.07 63.73 124.22 32.72 60.75 122.39 -4.31 29.33 -0.01 -0.74 29.76 -4.84 coo 38.49 66.12 125.64 35.69 66.71 131.25 -7.03 31.61 -1.42 -10.99 31.33 -6.00 coo 41.08 63.27 123.17 40.13 62.43 122.44 -9.43 30.44 2.60 -10.58 29.73 3.07 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 2 3 # 2 A 40 LYS A 35 LYS~? 14.51 O1 GOL A 2 A 41 LYS A 34 LYS~? 16.07 O1 GOL A 2 A 42 ILE A 36 ILE~? 13.49 O2 GOL B 3 coo 36.07 63.73 124.22 32.72 60.75 122.39 -7.03 31.61 -1.42 -10.99 31.33 -6.00 coo 38.49 66.12 125.64 35.69 66.71 131.25 -4.31 29.33 -0.01 -0.74 29.76 -4.84 coo 41.08 63.27 123.17 40.13 62.43 122.44 -9.43 30.44 2.60 -10.58 29.73 3.07 1pyi_d00 source 1pyi PROTEIN (PYRIMIDINE PATHWAY REGULATOR 1) : 2 hits 1pyi_d00 naa= 3 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 1 3 # 1 A1290 LYS B 92 LYS~? 4.07 O3 GOL B 3 A1294 ASN B 90 ASN~? -3.47 O2 GOL B 4s A1297 GLU B 57 GLU~? -4.12 O3 GOL B 4s coo 39.24 18.84-161.99 36.62 21.47-165.99 -29.46 26.70 6.25 -26.96 24.00 2.30 coo 33.53 17.37-161.81 34.31 17.81-163.76 -32.17 23.75 11.87 -32.87 25.37 13.10 coo 29.78 23.31-161.30 31.23 23.66-162.84 -25.78 25.15 16.73 -26.80 26.19 18.23 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 2 3 # 2 A1290 LYS B 92 LYS~? 4.07 O3 GOL B 3 A1294 ASN B 90 ASN~? -3.47 O2 GOL B 4s A1297 GLU B 86 GLU~? 9.00 O1 GOL B 4 coo 39.24 18.84-161.99 36.62 21.47-165.99 -29.46 26.70 6.25 -26.96 24.00 2.30 coo 33.53 17.37-161.81 34.31 17.81-163.76 -32.17 23.75 11.87 -32.87 25.37 13.10 coo 29.78 23.31-161.30 31.23 23.66-162.84 -35.32 17.29 11.75 -36.56 18.30 10.39 1xpx_d00 source 1xpx TRANSCRIPTION REGULATION/DNA : 2 hits 1xpx_d00 naa= 3 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 21 GLN B 37 GLN~? 14.25 C1 GOL B 4 A 41 TYR B 39 TYR~? 12.50 O1 GOL B 4 A 43 ASN B 38 ASN~? 14.67 O3 GOL A 2 coo 22.03 6.35 12.16 20.71 6.08 10.54 -19.14 15.27 12.57 -17.14 15.08 13.30 coo 18.67 0.21 9.03 16.70 -1.66 8.55 -26.88 11.91 8.14 -29.28 12.36 6.79 coo 14.90 7.30 8.78 14.25 8.14 6.97 -20.70 9.72 9.05 -20.50 8.46 7.38 3ssc_d00 source 3ssc DNA BINDING PROTEIN/DNA : 1 hits 3ssc_d00 naa= 3 ULMN 3 3uby_d00 HYDROLASE/DNA user 1 3 # 1 A 162 TYR A 15 TYR~? 22.28 O1 GOL A 2 A 164 MET A 18 MET?? 18.22 O3 GOL A 2 A 165 TYR A 56 TYR~? 21.37 C3 GOL A 2 coo 9.07 -0.64 37.53 6.51 -1.49 38.21 2.18 28.14 10.75 1.63 29.43 8.35 coo 15.31 0.97 33.48 17.04 -1.81 36.11 -0.80 22.39 9.92 -3.55 22.14 12.09 coo 12.73 -3.12 32.95 14.22 -4.94 34.46 -4.76 25.74 13.22 -2.26 27.02 13.36 ULMN 3 3uby_d00 HYDROLASE/DNA user 2 3 # 2 A 162 TYR A 56 TYR~? 21.37 C3 GOL A 2 A 164 MET A 18 MET?? 18.22 O3 GOL A 2 A 165 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 9.07 -0.64 37.53 6.51 -1.49 38.21 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 15.31 0.97 33.48 17.04 -1.81 36.11 -0.80 22.39 9.92 -3.55 22.14 12.09 coo 12.73 -3.12 32.95 14.22 -4.94 34.46 2.18 28.14 10.75 1.63 29.43 8.35 ULMN 3 3uby_d00 HYDROLASE/DNA user 3 3 # 3 A 162 TYR A 56 TYR~? 21.37 C3 GOL A 2 A 164 MET A 19 MET?? 17.86 O1 GOL A 2 A 165 TYR A 15 TYR~? 22.28 O1 GOL A 2 coo 9.07 -0.64 37.53 6.51 -1.49 38.21 -4.76 25.74 13.22 -2.26 27.02 13.36 coo 15.31 0.97 33.48 17.04 -1.81 36.11 0.75 23.56 6.63 -0.24 26.65 6.26 coo 12.73 -3.12 32.95 14.22 -4.94 34.46 2.18 28.14 10.75 1.63 29.43 8.35 3uby_d00 source 3uby HYDROLASE/DNA : 3 hits 3uby_d00 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 78 GLU.? 14.22 O2 GOL B 3 A 44 ASP A 74 ASP~? -7.66 O2 GOL A 2s A 50 THR A 76 THR~? 10.21 O2 GOL B 3 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -18.73 27.47 -7.80 -19.43 27.49 -9.80 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -18.93 20.14 -2.22 -19.22 19.03 -4.07 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -16.80 26.53 0.10 -14.78 26.55 -0.66 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU A 86 GLU~? -2.98 O1 GOL B 3s A 44 ASP A 79 ASP~? 10.37 O2 GOL B 3 A 50 THR A 76 THR~? 10.21 O2 GOL B 3 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -20.52 33.51 6.85 -21.94 32.18 6.04 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -16.80 26.53 0.10 -14.78 26.55 -0.66 3hde_o00 source 3HDE LYSOZYME : 2 hits 3hde_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 86 GLU~? -2.98 O1 GOL B 3s B 44 ASP A 79 ASP~? 10.37 O2 GOL B 3 B 50 THR A 76 THR~? 10.21 O2 GOL B 3 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -20.52 33.51 6.85 -21.94 32.18 6.04 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -16.80 26.53 0.10 -14.78 26.55 -0.66 3hde_o01 source 3HDE LYSOZYME : 1 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 86 GLU~? -2.98 O1 GOL B 3s C 44 ASP A 79 ASP~? 10.37 O2 GOL B 3 C 50 THR A 76 THR~? 10.21 O2 GOL B 3 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -20.52 33.51 6.85 -21.94 32.18 6.04 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -18.83 33.10 -3.96 -18.26 35.08 -3.55 coo 25.48 4.87 1.60 23.90 4.95 0.15 -16.80 26.53 0.10 -14.78 26.55 -0.66 3hde_o02 source 3HDE LYSOZYME : 1 hits 3hde_o02 naa= 3