*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1c3c_c00 ADENYLOSUCCINATE LYASE user 1 4 # 1 A 140 THR A 60 THR.? 33.58 O1 FMT A 174 A 141 HIS A 59 HIS~? 37.22 O1 FMT A 174 B 268 LYS A 66 LYS~? 36.30 O1 FMT A 174 B 275 GLU A 55 GLU~? 39.06 O1 FMT A 174 coo 16.65 24.60 -11.79 15.27 24.83 -13.37 44.47 4.14 16.86 42.67 4.08 18.25 coo 19.95 22.68 -14.22 18.84 21.46 -15.51 50.17 1.75 17.58 51.60 1.04 18.95 coo 21.08 30.27 -18.41 15.59 30.60 -20.63 52.34 7.32 12.03 54.08 9.90 7.62 coo 23.65 19.24 -11.79 22.04 20.41 -12.47 52.13 -3.22 18.42 54.09 -2.61 19.04 1c3c_c00 source 1c3c ADENYLOSUCCINATE LYASE : 1 hits 1c3c_c00 naa= 4 ULMN 4 1c3c_c01 ADENYLOSUCCINATE LYASE user 1 4 # 1 A 268 LYS A 66 LYS~? 36.30 O1 FMT A 174 A 275 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 140 THR A 60 THR.? 33.58 O1 FMT A 174 B 141 HIS A 59 HIS~? 37.22 O1 FMT A 174 coo 27.05 33.60 11.30 32.58 34.41 13.42 52.34 7.32 12.03 54.08 9.90 7.62 coo 24.46 21.32 7.28 26.08 22.63 7.70 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 31.44 26.62 6.14 32.83 27.21 7.66 44.47 4.14 16.86 42.67 4.08 18.25 coo 28.18 25.24 8.94 29.28 24.32 10.48 50.17 1.75 17.58 51.60 1.04 18.95 1c3c_c01 source 1c3c ADENYLOSUCCINATE LYASE : 1 hits 1c3c_c01 naa= 4 ULMN 4 1d8h_c00 MRNA TRIPHOSPHATASE CET1 user 1 4 # 1 A 393 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 433 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 456 LYS A 157 LYS~? 15.32 C FMT A 174 A 458 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 8.61 51.76 73.74 9.78 51.49 70.80 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 14.59 54.44 69.55 14.31 53.05 67.99 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 1.72 46.30 68.29 5.79 48.68 67.64 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 6.20 47.59 62.97 6.73 49.77 65.20 20.90 -10.04 -7.22 20.67 -7.48 -5.33 1d8h_c00 source 1d8h MRNA TRIPHOSPHATASE CET1 : 1 hits 1d8h_c00 naa= 4 ULMN 4 1d8h_c01 MRNA TRIPHOSPHATASE CET1 user 1 4 # 1 B 393 ARG A 163 ARG~? 6.61 O2 FMT A 175 B 433 GLU A 106 GLU~? -4.32 O2 FMT A 174s B 456 LYS A 157 LYS~? 15.32 C FMT A 174 B 458 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo -1.83 99.06 29.59 -0.10 96.84 28.90 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo -1.96 91.25 27.47 0.16 91.64 27.05 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 7.52 102.36 32.33 4.96 99.05 30.60 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 9.47 95.54 30.17 6.44 95.66 31.22 20.90 -10.04 -7.22 20.67 -7.48 -5.33 1d8h_c01 source 1d8h MRNA TRIPHOSPHATASE CET1 : 1 hits 1d8h_c01 naa= 4 ULMN 4 1f75_c00 UNDECAPRENYL PYROPHOSPHATE SYNTHETASuser 1 4 # 1 A 33 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 42 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 197 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 203 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 23.24 19.51 21.94 24.57 16.76 21.61 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 16.08 17.48 28.78 19.09 16.85 28.49 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 28.26 9.63 19.68 28.71 10.56 22.55 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 33.62 12.31 23.18 30.84 12.90 24.36 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 4 1f75_c00 UNDECAPRENYL PYROPHOSPHATE SYNTHETASuser 2 4 # 2 A 33 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 42 ARG A 101 ARG~? 6.72 O2 FMT A 176 A 197 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 203 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 23.24 19.51 21.94 24.57 16.76 21.61 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 16.08 17.48 28.78 19.09 16.85 28.49 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 28.26 9.63 19.68 28.71 10.56 22.55 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 33.62 12.31 23.18 30.84 12.90 24.36 20.90 -10.04 -7.22 20.67 -7.48 -5.33 1f75_c00 source 1f75 UNDECAPRENYL PYROPHOSPHATE SYNTHETASE : 2 hits 1f75_c00 naa= 4 ULMN 4 1fuq_c01 FUMARASE C user 1 4 # 1 A 187 THR A 60 THR.? 33.58 O1 FMT A 174 A 188 HIS A 59 HIS~? 37.22 O1 FMT A 174 B 324 LYS A 66 LYS~? 36.30 O1 FMT A 174 B 331 GLU A 55 GLU~? 39.06 O1 FMT A 174 coo 129.74 131.38 71.57 131.00 129.90 70.56 44.47 4.14 16.86 42.67 4.08 18.25 coo 126.65 128.38 73.20 126.33 126.91 71.74 50.17 1.75 17.58 51.60 1.04 18.95 coo 132.83 126.01 79.21 131.24 127.86 74.38 52.34 7.32 12.03 54.08 9.90 7.62 coo 121.10 128.95 74.81 122.81 127.96 74.05 52.13 -3.22 18.42 54.09 -2.61 19.04 1fuq_c01 source 1fuq FUMARASE C : 1 hits 1fuq_c01 naa= 4 ULMN 4 1p4n_c00 UDP-MURNAC-PENTAPEPTIDE user 1 4 # 1 A 36 LYS A 122 LYS~? 10.14 O4 PEG A 177 A 108 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 211 ARG A 132 ARG~? 15.71 O4 PEG A 177 A 319 GLU A 167 GLU~? -4.28 O1 FMT A 176s coo 26.40 -0.07 5.65 25.70 1.89 10.82 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo 13.95 1.15 16.48 15.65 1.17 15.18 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 30.30 5.19 11.85 28.49 2.83 12.64 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 15.01 -1.52 19.72 16.83 -2.42 20.27 35.33 -23.68 -13.20 34.70 -25.59 -12.86 1p4n_c00 source 1p4n UDP-MURNAC-PENTAPEPTIDE : 1 hits 1p4n_c00 naa= 4 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 1 3 # 1 A 46 ASP A 47 ASP~? 38.21 O1 FMT A 175 A 100 ARG A 50 ARG~? 30.44 C FMT A 175 A 116 GLN A 79 GLN~? 36.69 O2 FMT A 175 coo 32.24 20.09 5.34 30.38 19.04 5.27 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 26.40 25.34 6.28 26.15 22.33 7.25 56.17 -13.83 11.47 55.95 -14.59 8.45 coo 26.74 21.94 13.78 27.57 20.97 12.08 61.52 -7.02 6.20 61.63 -8.21 7.89 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 2 3 # 2 A 46 ASP A 78 ASP~? 43.27 O2 FMT A 175 A 100 ARG A 77 ARG~? 44.68 O1 FMT A 174 A 116 GLN A 81 GLN~? 38.84 O1 FMT A 174 coo 32.24 20.09 5.34 30.38 19.04 5.27 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 26.40 25.34 6.28 26.15 22.33 7.25 66.39 1.10 5.82 67.17 3.11 8.07 coo 26.74 21.94 13.78 27.57 20.97 12.08 62.89 -4.54 1.02 64.71 -3.45 1.05 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 3 3 # 3 A 46 ASP A 89 ASP~? 23.36 C FMT A 176 A 100 ARG A 96 ARG~? 20.74 C4 PEG A 177 A 116 GLN A 97 GLN~? 15.54 C FMT A 176 coo 32.24 20.09 5.34 30.38 19.04 5.27 54.15 -9.18 -8.18 53.50 -9.22 -10.26 coo 26.40 25.34 6.28 26.15 22.33 7.25 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 26.74 21.94 13.78 27.57 20.97 12.08 45.14 -13.44 -14.02 47.07 -13.14 -13.05 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 4 3 # 4 A 46 ASP A 117 ASP~? 15.82 O1 PEG A 177 A 100 ARG A 132 ARG~? 15.71 O4 PEG A 177 A 116 GLN A 133 GLN~? 22.50 O2 FMT A 176 coo 32.24 20.09 5.34 30.38 19.04 5.27 18.71 -17.67 -30.43 18.68 -19.55 -29.48 coo 26.40 25.34 6.28 26.15 22.33 7.25 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 26.74 21.94 13.78 27.57 20.97 12.08 16.47 -26.98 -23.32 14.59 -25.97 -23.92 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 5 3 # 5 A 46 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 100 ARG A 101 ARG~? 6.72 O2 FMT A 176 A 116 GLN A 169 GLN~? 8.14 O2 FMT A 175 coo 32.24 20.09 5.34 30.38 19.04 5.27 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 26.40 25.34 6.28 26.15 22.33 7.25 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 26.74 21.94 13.78 27.57 20.97 12.08 37.14 -18.48 -5.87 38.76 -17.82 -7.13 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 6 3 # 6 A 46 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 100 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 116 GLN A 169 GLN~? 8.14 O2 FMT A 175 coo 32.24 20.09 5.34 30.38 19.04 5.27 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 26.40 25.34 6.28 26.15 22.33 7.25 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 26.74 21.94 13.78 27.57 20.97 12.08 37.14 -18.48 -5.87 38.76 -17.82 -7.13 12as_c00 source 12as ASPARAGINE SYNTHETASE : 6 hits 12as_c00 naa= 3 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 1 3 # 1 B 46 ASP A 78 ASP~? 43.27 O2 FMT A 175 B 100 ARG A 77 ARG~? 44.68 O1 FMT A 174 B 116 GLN A 81 GLN~? 38.84 O1 FMT A 174 coo 32.18 48.37 12.48 33.96 49.46 12.97 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 39.04 43.25 11.37 38.30 45.35 13.56 66.39 1.10 5.82 67.17 3.11 8.07 coo 37.43 42.63 19.41 36.76 44.08 17.97 62.89 -4.54 1.02 64.71 -3.45 1.05 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 # 2 B 46 ASP A 89 ASP~? 23.36 C FMT A 176 B 100 ARG A 96 ARG~? 20.74 C4 PEG A 177 B 116 GLN A 97 GLN~? 15.54 C FMT A 176 coo 32.18 48.37 12.48 33.96 49.46 12.97 54.15 -9.18 -8.18 53.50 -9.22 -10.26 coo 39.04 43.25 11.37 38.30 45.35 13.56 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 37.43 42.63 19.41 36.76 44.08 17.97 45.14 -13.44 -14.02 47.07 -13.14 -13.05 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 3 3 # 3 B 46 ASP A 117 ASP~? 15.82 O1 PEG A 177 B 100 ARG A 132 ARG~? 15.71 O4 PEG A 177 B 116 GLN A 133 GLN~? 22.50 O2 FMT A 176 coo 32.18 48.37 12.48 33.96 49.46 12.97 18.71 -17.67 -30.43 18.68 -19.55 -29.48 coo 39.04 43.25 11.37 38.30 45.35 13.56 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 37.43 42.63 19.41 36.76 44.08 17.97 16.47 -26.98 -23.32 14.59 -25.97 -23.92 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 4 3 # 4 B 46 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 100 ARG A 163 ARG~? 6.61 O2 FMT A 175 B 116 GLN A 169 GLN~? 8.14 O2 FMT A 175 coo 32.18 48.37 12.48 33.96 49.46 12.97 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 39.04 43.25 11.37 38.30 45.35 13.56 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 37.43 42.63 19.41 36.76 44.08 17.97 37.14 -18.48 -5.87 38.76 -17.82 -7.13 12as_c01 source 12as ASPARAGINE SYNTHETASE : 4 hits 12as_c01 naa= 3 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 140 TYR A 127 TYR~? 5.76 O2 FMT A 176 B 190 LYS A 122 LYS~? 10.14 O4 PEG A 177 B 222 ASP A 119 ASP~? 7.68 O1 PEG A 177 coo 7.17 16.59 41.26 8.01 19.20 40.73 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 13.38 20.00 35.06 11.43 22.49 39.53 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo 9.76 26.58 38.10 11.63 25.78 38.76 23.95 -13.44 -27.62 23.92 -11.77 -28.82 1a05_c00 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 1 hits 1a05_c00 naa= 3 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 190 LYS A 122 LYS~? 10.14 O4 PEG A 177 A 222 ASP A 119 ASP~? 7.68 O1 PEG A 177 B 140 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo -4.61 20.12 30.34 -2.74 22.65 25.95 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo -1.04 26.60 27.37 -2.94 25.93 26.69 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 1.51 16.60 24.17 0.82 19.23 24.79 31.30 -20.95 -20.60 32.94 -18.93 -19.47 1a05_c01 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 1 hits 1a05_c01 naa= 3 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 101 ARG~? 6.72 O2 FMT A 176 265 HIS A 103 HIS~? 8.30 O2 FMT A 174 274 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo -15.18 55.46 8.55 -14.82 52.98 10.38 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo -14.48 45.59 11.18 -14.02 47.49 10.42 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 0.94 52.26 9.16 1.95 54.78 9.91 23.82 -21.26 -14.80 24.13 -23.57 -16.35 1a41_c01 source 1a41 TOPOISOMERASE I : 1 hits 1a41_c01 naa= 3 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 100 GLU~? 11.75 C4 PEG A 177 A 60 ASP A 92 ASP~? 21.45 O1 FMT A 174 A 175 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 46.10 28.27 19.27 45.48 26.99 20.84 41.90 -9.49 -16.18 43.86 -10.09 -17.17 coo 56.42 28.06 12.93 55.01 27.92 14.50 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 45.02 22.04 15.38 46.16 24.00 13.76 38.55 -12.80 -8.86 35.99 -13.04 -7.80 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 2 3 # 2 A 49 GLU A 126 GLU~? 5.29 O4 PEG A 177 A 60 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 175 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 46.10 28.27 19.27 45.48 26.99 20.84 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 56.42 28.06 12.93 55.01 27.92 14.50 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 45.02 22.04 15.38 46.16 24.00 13.76 31.30 -20.95 -20.60 32.94 -18.93 -19.47 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 2 hits 1a50_c03 naa= 3 ULMN 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 1 3 # 1 16 ALA A 52 ALA~? 36.86 O1 FMT A 174 19 HIS A 59 HIS~? 37.22 O1 FMT A 174 22 HIS A 68 HIS~? 36.06 O1 FMT A 174 coo 53.27 36.51 45.29 51.98 36.45 44.47 55.15 -4.93 14.69 56.17 -4.23 13.82 coo 46.88 33.59 48.26 46.24 34.32 46.40 50.17 1.75 17.58 51.60 1.04 18.95 coo 48.05 31.12 44.60 48.20 33.05 43.77 53.15 0.53 14.80 53.37 -1.51 15.17 ULMN 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 2 3 # 2 16 ALA A 52 ALA~? 36.86 O1 FMT A 174 19 HIS A 68 HIS~? 36.06 O1 FMT A 174 22 HIS A 59 HIS~? 37.22 O1 FMT A 174 coo 53.27 36.51 45.29 51.98 36.45 44.47 55.15 -4.93 14.69 56.17 -4.23 13.82 coo 46.88 33.59 48.26 46.24 34.32 46.40 53.15 0.53 14.80 53.37 -1.51 15.17 coo 48.05 31.12 44.60 48.20 33.05 43.77 50.17 1.75 17.58 51.60 1.04 18.95 1a8h_c02 source 1a8h METHIONYL-TRNA SYNTHETASE : 2 hits 1a8h_c02 naa= 3 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 1 3 # 1 142 TRP A 108 TRP~? -4.03 C1 PEG A 177s 223 ASP A 110 ASP~? 7.00 O2 FMT A 174 258 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 127.19 33.46 26.14 126.78 36.79 28.15 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 126.95 41.66 23.38 128.48 40.72 24.51 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 138.83 37.95 25.17 133.50 36.37 26.52 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1aam_c01 source 1aam ASPARTATE AMINOTRANSFERASE : 1 hits 1aam_c01 naa= 3 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 1 3 # 1 22 ASN A 99 ASN~? 12.05 O2 FMT A 174 63 ARG A 96 ARG~? 20.74 C4 PEG A 177 255 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 42.10 13.02 11.14 41.85 11.12 10.23 39.44 -8.04 -11.63 39.55 -7.84 -9.53 coo 44.36 11.24 3.39 41.81 12.78 4.00 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 38.40 3.83 10.26 40.02 6.30 9.25 39.00 -16.21 -14.42 38.67 -18.83 -12.88 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 2 3 # 2 22 ASN A 99 ASN~? 12.05 O2 FMT A 174 63 ARG A 101 ARG~? 6.72 O2 FMT A 176 255 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 42.10 13.02 11.14 41.85 11.12 10.23 39.44 -8.04 -11.63 39.55 -7.84 -9.53 coo 44.36 11.24 3.39 41.81 12.78 4.00 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 38.40 3.83 10.26 40.02 6.30 9.25 32.48 -6.37 -21.24 35.08 -7.16 -19.82 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 3 3 # 3 22 ASN A 104 ASN~? -3.09 C4 PEG A 177s 63 ARG A 101 ARG~? 6.72 O2 FMT A 176 255 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 42.10 13.02 11.14 41.85 11.12 10.23 35.06 -12.01 -19.02 34.43 -13.28 -20.72 coo 44.36 11.24 3.39 41.81 12.78 4.00 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 38.40 3.83 10.26 40.02 6.30 9.25 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 4 3 # 4 22 ASN A 104 ASN~? -3.09 C4 PEG A 177s 63 ARG A 107 ARG~? -5.14 O2 PEG A 177s 255 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 42.10 13.02 11.14 41.85 11.12 10.23 35.06 -12.01 -19.02 34.43 -13.28 -20.72 coo 44.36 11.24 3.39 41.81 12.78 4.00 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 38.40 3.83 10.26 40.02 6.30 9.25 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1aj0_c00 source 1aj0 DIHYDROPTEROATE SYNTHASE : 4 hits 1aj0_c00 naa= 3 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 1 3 # 1 33 ASP A 129 ASP~? 7.83 O1 FMT A 176 187 GLU A 126 GLU~? 5.29 O4 PEG A 177 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -52.57 56.60 47.75 -51.52 54.87 46.95 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo -45.08 48.37 46.81 -46.53 49.74 45.96 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo -47.40 44.36 48.48 -50.80 49.18 46.20 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 2 3 # 2 33 ASP A 131 ASP~? 16.41 O2 FMT A 176 187 GLU A 164 GLU~? 5.82 O1 FMT A 175 229 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo -52.57 56.60 47.75 -51.52 54.87 46.95 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo -45.08 48.37 46.81 -46.53 49.74 45.96 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo -47.40 44.36 48.48 -50.80 49.18 46.20 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 3 3 # 3 33 ASP A 166 ASP~? 5.39 O2 FMT A 176 187 GLU A 126 GLU~? 5.29 O4 PEG A 177 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -52.57 56.60 47.75 -51.52 54.87 46.95 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -45.08 48.37 46.81 -46.53 49.74 45.96 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo -47.40 44.36 48.48 -50.80 49.18 46.20 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1ald_c00 source 1ald ALDOLASE A (E.C.4.1.2.13) : 3 hits 1ald_c00 naa= 3 ULMN 3 1am5_c04 PEPSIN user 1 3 # 1 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 35 SER A 94 SER~? 15.65 O2 FMT A 175 215 ASP A 89 ASP~? 23.36 C FMT A 176 coo -7.18 8.92 145.10 -8.77 8.81 143.59 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo -12.30 10.35 145.24 -10.75 8.55 145.88 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo -8.20 12.64 138.30 -8.86 10.97 139.38 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1am5_c04 source 1am5 PEPSIN : 1 hits 1am5_c04 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 119 ASP~? 7.68 O1 PEG A 177 214 ASP A 92 ASP~? 21.45 O1 FMT A 174 289 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo -0.62 65.95 29.97 0.31 67.47 31.05 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 26.86 59.76 46.36 25.42 58.23 45.92 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 9.42 68.07 30.27 7.35 68.27 30.10 25.17 -6.99 -19.79 25.21 -6.55 -17.70 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 129 ASP~? 7.83 O1 FMT A 176 214 ASP A 38 ASP~? 19.22 O1 FMT A 175 289 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo -0.62 65.95 29.97 0.31 67.47 31.05 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 26.86 59.76 46.36 25.42 58.23 45.92 46.18 -16.53 5.44 45.49 -18.23 4.73 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 -18.89 -15.18 35.30 -18.02 -15.79 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 129 ASP~? 7.83 O1 FMT A 176 214 ASP A 89 ASP~? 23.36 C FMT A 176 289 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo -0.62 65.95 29.97 0.31 67.47 31.05 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 26.86 59.76 46.36 25.42 58.23 45.92 54.15 -9.18 -8.18 53.50 -9.22 -10.26 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 -18.89 -15.18 35.30 -18.02 -15.79 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 A 166 ASP~? 5.39 O2 FMT A 176 204 GLU A 167 GLU~? -4.28 O1 FMT A 176s 289 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 4.34 62.44 32.05 4.22 64.48 32.53 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 9.42 68.07 30.27 7.35 68.27 30.10 29.91 -28.16 -19.91 31.33 -29.73 -20.56 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 78 ASP~? 43.27 O2 FMT A 175 227 GLU A 30 GLU~? 28.79 O1 FMT A 174 289 ASP A 80 ASP~? 35.02 C FMT A 176 coo -0.62 65.95 29.97 0.31 67.47 31.05 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 3.96 55.76 41.24 4.83 57.69 41.17 50.95 1.74 4.18 49.94 3.63 4.45 coo 9.42 68.07 30.27 7.35 68.27 30.10 64.20 -10.93 1.69 64.86 -11.65 -0.10 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 110 ASP~? 7.00 O2 FMT A 174 227 GLU A 145 GLU~? 14.25 C FMT A 174 289 ASP A 119 ASP~? 7.68 O1 PEG A 177 coo -0.62 65.95 29.97 0.31 67.47 31.05 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 3.96 55.76 41.24 4.83 57.69 41.17 12.14 -10.58 -14.19 13.77 -11.35 -13.11 coo 9.42 68.07 30.27 7.35 68.27 30.10 23.95 -13.44 -27.62 23.92 -11.77 -28.82 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 129 ASP~? 7.83 O1 FMT A 176 227 GLU A 121 GLU~? 15.09 C1 PEG A 177 289 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo -0.62 65.95 29.97 0.31 67.47 31.05 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 3.96 55.76 41.24 4.83 57.69 41.17 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 3 hits 1amy_c06 naa= 3 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 # 1 E 33 ASP A 92 ASP~? 21.45 O1 FMT A 174 E 36 SER A 94 SER~? 15.65 O2 FMT A 175 E 213 ASP A 89 ASP~? 23.36 C FMT A 176 coo 26.30 12.96 16.78 25.46 12.99 18.72 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 28.33 15.15 21.27 28.70 13.12 19.97 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 20.15 16.04 19.79 21.65 14.49 19.86 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1apt_c04 source 1apt ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET (LYSTA IS : 1 hits 1apt_c04 naa= 3 ULMN 3 1apx_c00 CYTOSOLIC ASCORBATE PEROXIDASE user 1 3 # 1 A 38 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 42 HIS A 103 HIS~? 8.30 O2 FMT A 174 A 71 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo 15.53 3.67 5.89 15.40 6.73 5.59 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 20.65 4.50 6.93 19.74 4.89 5.08 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 19.78 9.98 8.03 21.51 8.73 8.26 35.06 -12.01 -19.02 34.43 -13.28 -20.72 1apx_c00 source 1apx CYTOSOLIC ASCORBATE PEROXIDASE : 1 hits 1apx_c00 naa= 3 ULMN 3 1apx_c01 CYTOSOLIC ASCORBATE PEROXIDASE user 1 3 # 1 B 38 ARG A 107 ARG~? -5.14 O2 PEG A 177s B 42 HIS A 103 HIS~? 8.30 O2 FMT A 174 B 71 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo -9.60 -18.19 23.08 -12.38 -18.82 21.94 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -9.36 -23.33 24.70 -10.73 -22.14 25.75 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo -13.50 -24.69 21.19 -12.38 -25.89 22.55 35.06 -12.01 -19.02 34.43 -13.28 -20.72 1apx_c01 source 1apx CYTOSOLIC ASCORBATE PEROXIDASE : 1 hits 1apx_c01 naa= 3 ULMN 3 1apx_c02 CYTOSOLIC ASCORBATE PEROXIDASE user 1 3 # 1 C 38 ARG A 107 ARG~? -5.14 O2 PEG A 177s C 42 HIS A 103 HIS~? 8.30 O2 FMT A 174 C 71 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo 30.92 18.62 52.11 32.84 21.02 52.26 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 34.83 15.89 54.93 35.12 16.59 52.97 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 37.12 20.79 56.54 37.65 18.79 57.02 35.06 -12.01 -19.02 34.43 -13.28 -20.72 1apx_c02 source 1apx CYTOSOLIC ASCORBATE PEROXIDASE : 1 hits 1apx_c02 naa= 3 ULMN 3 1apx_c03 CYTOSOLIC ASCORBATE PEROXIDASE user 1 3 # 1 D 38 ARG A 107 ARG~? -5.14 O2 PEG A 177s D 42 HIS A 103 HIS~? 8.30 O2 FMT A 174 D 71 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo -6.22 19.15 57.90 -8.28 20.35 55.95 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -9.68 15.08 58.37 -9.88 17.07 58.99 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo -12.42 16.33 53.67 -12.99 14.86 55.12 35.06 -12.01 -19.02 34.43 -13.28 -20.72 1apx_c03 source 1apx CYTOSOLIC ASCORBATE PEROXIDASE : 1 hits 1apx_c03 naa= 3 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 A 194 SER A 94 SER~? 15.65 O2 FMT A 175 A 292 ASP A 80 ASP~? 35.02 C FMT A 176 A 322 HIS A 103 HIS~? 8.30 O2 FMT A 174 coo 36.34 32.23 39.60 36.43 34.62 39.93 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 19.73 19.18 41.39 21.50 18.65 40.34 64.20 -10.93 1.69 64.86 -11.65 -0.10 coo 41.69 45.14 46.60 41.78 47.19 46.18 35.22 -6.46 -14.60 35.44 -5.32 -12.85 1aql_c02 source 1aql BILE-SALT ACTIVATED LIPASE : 1 hits 1aql_c02 naa= 3 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 B 194 SER A 94 SER~? 15.65 O2 FMT A 175 B 292 ASP A 80 ASP~? 35.02 C FMT A 176 B 322 HIS A 103 HIS~? 8.30 O2 FMT A 174 coo 35.42 71.28 22.94 36.24 69.06 22.37 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 24.74 78.07 5.59 24.32 79.03 7.46 64.20 -10.93 1.69 64.86 -11.65 -0.10 coo 48.81 64.16 26.34 49.30 62.16 26.73 35.22 -6.46 -14.60 35.44 -5.32 -12.85 1aql_c03 source 1aql BILE-SALT ACTIVATED LIPASE : 1 hits 1aql_c03 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 65 ARG~? 29.62 O1 FMT A 174 B 342 ASP A 27 ASP~? 30.54 O1 FMT A 174 B 531 ARG A 67 ARG~? 43.16 O1 FMT A 174 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 47.05 3.71 11.47 47.46 0.69 10.93 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 54.21 2.61 0.04 53.68 4.66 -0.22 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 57.57 5.82 16.12 60.39 6.14 14.88 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 B 325 ARG A 107 ARG~? -5.14 O2 PEG A 177s B 342 ASP A 119 ASP~? 7.68 O1 PEG A 177 B 531 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 68.60 41.07 -12.62 69.17 40.45 -9.67 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 B 325 ARG A 109 ARG~? -3.22 O2 FMT A 174s B 342 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 531 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 68.60 41.07 -12.62 69.17 40.45 -9.67 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 32.48 -6.37 -21.24 35.08 -7.16 -19.82 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 B 325 ARG A 109 ARG~? -3.22 O2 FMT A 174s B 342 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 531 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 68.60 41.07 -12.62 69.17 40.45 -9.67 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 B 325 ARG A 111 ARG~? -4.31 O1 PEG A 177s B 342 ASP A 116 ASP~? 12.69 O1 PEG A 177 B 531 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 68.60 41.07 -12.62 69.17 40.45 -9.67 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 B 325 ARG A 156 ARG~? 7.82 O1 FMT A 174 B 342 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 531 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 30.03 -15.29 -9.70 32.00 -14.53 -7.50 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 6 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 65 ARG~? 29.62 O1 FMT A 174 A 342 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 531 ARG A 67 ARG~? 43.16 O1 FMT A 174 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 47.05 3.71 11.47 47.46 0.69 10.93 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 54.21 2.61 0.04 53.68 4.66 -0.22 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 57.57 5.82 16.12 60.39 6.14 14.88 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 A 325 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 342 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 531 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 A 325 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 342 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 531 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 32.48 -6.37 -21.24 35.08 -7.16 -19.82 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 A 325 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 342 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 531 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 A 325 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 342 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 531 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 A 325 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 342 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 531 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 20.90 -10.04 -7.22 20.67 -7.48 -5.33 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 6 hits 1asy_c01 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 102 PHE~? 5.11 C FMT A 174 A 223 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 39.74 52.86 65.74 41.15 55.14 66.52 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 30.70 47.50 67.53 29.83 49.47 67.39 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 19.99 54.53 64.11 20.55 58.78 68.33 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE A 102 PHE~? 5.11 C FMT A 174 A 223 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 39.74 52.86 65.74 41.15 55.14 66.52 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 30.70 47.50 67.53 29.83 49.47 67.39 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 19.99 54.53 64.11 20.55 58.78 68.33 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1ax4_c04 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 102 PHE~? 5.11 C FMT A 174 B 223 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 7.48 54.94 99.62 7.67 52.27 100.42 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 10.43 61.66 91.81 9.80 60.04 90.61 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 5.43 58.06 80.08 8.57 53.00 79.37 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE A 102 PHE~? 5.11 C FMT A 174 B 223 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 7.48 54.94 99.62 7.67 52.27 100.42 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 10.43 61.66 91.81 9.80 60.04 90.61 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 5.43 58.06 80.08 8.57 53.00 79.37 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1ax4_c05 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 102 PHE~? 5.11 C FMT A 174 C 223 ASP A 110 ASP~? 7.00 O2 FMT A 174 C 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -6.55 73.45 23.60 -6.77 71.48 21.66 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo -9.52 75.74 33.62 -8.85 73.74 33.93 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -4.44 67.20 42.32 -7.50 62.41 40.49 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE A 102 PHE~? 5.11 C FMT A 174 C 223 ASP A 166 ASP~? 5.39 O2 FMT A 176 C 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -6.55 73.45 23.60 -6.77 71.48 21.66 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo -9.52 75.74 33.62 -8.85 73.74 33.93 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -4.44 67.20 42.32 -7.50 62.41 40.49 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1ax4_c06 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 102 PHE~? 5.11 C FMT A 174 D 223 ASP A 110 ASP~? 7.00 O2 FMT A 174 D 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -38.60 55.38 52.70 -40.06 57.72 53.04 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo -29.46 51.67 48.51 -28.63 53.31 49.56 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -18.87 56.53 54.79 -19.47 62.22 53.03 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE A 102 PHE~? 5.11 C FMT A 174 D 223 ASP A 166 ASP~? 5.39 O2 FMT A 176 D 265 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -38.60 55.38 52.70 -40.06 57.72 53.04 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo -29.46 51.67 48.51 -28.63 53.31 49.56 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -18.87 56.53 54.79 -19.47 62.22 53.03 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1ax4_c07 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c07 naa= 3 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 A 140 TRP A 108 TRP~? -4.03 C1 PEG A 177s A 222 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 258 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 89.83 15.40 0.01 90.61 18.86 1.71 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 82.92 20.43 2.47 84.82 20.45 1.55 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1ay4_c02 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 1 hits 1ay4_c02 naa= 3 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 B 140 TRP A 108 TRP~? -4.03 C1 PEG A 177s B 222 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 258 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 103.45 44.39 16.20 102.66 41.02 14.32 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 110.10 38.66 15.58 108.40 39.41 14.53 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 107.51 45.54 4.76 105.41 44.51 10.25 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1ay4_c03 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 1 hits 1ay4_c03 naa= 3 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 1 3 # 1 A 85 HIS A 59 HIS~? 37.22 O1 FMT A 174 A 171 ARG A 31 ARG~? 22.01 O1 FMT A 174 A 190 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 22.59 2.26 43.22 21.17 3.47 42.27 50.17 1.75 17.58 51.60 1.04 18.95 coo 13.63 3.81 28.83 14.49 2.91 31.59 48.96 -3.53 -0.04 48.31 -5.49 -2.36 coo 24.97 7.47 37.69 21.24 10.69 35.89 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 2 3 # 2 A 85 HIS A 68 HIS~? 36.06 O1 FMT A 174 A 171 ARG A 31 ARG~? 22.01 O1 FMT A 174 A 190 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 22.59 2.26 43.22 21.17 3.47 42.27 53.15 0.53 14.80 53.37 -1.51 15.17 coo 13.63 3.81 28.83 14.49 2.91 31.59 48.96 -3.53 -0.04 48.31 -5.49 -2.36 coo 24.97 7.47 37.69 21.24 10.69 35.89 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 3 3 # 3 A 85 HIS A 68 HIS~? 36.06 O1 FMT A 174 A 171 ARG A 77 ARG~? 44.68 O1 FMT A 174 A 190 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 22.59 2.26 43.22 21.17 3.47 42.27 53.15 0.53 14.80 53.37 -1.51 15.17 coo 13.63 3.81 28.83 14.49 2.91 31.59 66.39 1.10 5.82 67.17 3.11 8.07 coo 24.97 7.47 37.69 21.24 10.69 35.89 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 4 3 # 4 A 85 HIS A 144 HIS~? 21.24 O2 FMT A 174 A 171 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 190 LYS A 150 LYS~? 21.36 C FMT A 174 coo 22.59 2.26 43.22 21.17 3.47 42.27 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 13.63 3.81 28.83 14.49 2.91 31.59 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 24.97 7.47 37.69 21.24 10.69 35.89 10.40 -5.89 -12.34 6.45 -10.45 -13.59 1azy_c00 source 1azy THYMIDINE PHOSPHORYLASE : 4 hits 1azy_c00 naa= 3 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 1 3 # 1 B 85 HIS A 59 HIS~? 37.22 O1 FMT A 174 B 171 ARG A 31 ARG~? 22.01 O1 FMT A 174 B 190 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 50.17 1.75 17.58 51.60 1.04 18.95 coo 2.83 4.83 10.84 1.96 4.32 7.97 48.96 -3.53 -0.04 48.31 -5.49 -2.36 coo -8.96 9.04 2.88 -5.39 12.11 5.08 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 2 3 # 2 B 85 HIS A 68 HIS~? 36.06 O1 FMT A 174 B 171 ARG A 31 ARG~? 22.01 O1 FMT A 174 B 190 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 53.15 0.53 14.80 53.37 -1.51 15.17 coo 2.83 4.83 10.84 1.96 4.32 7.97 48.96 -3.53 -0.04 48.31 -5.49 -2.36 coo -8.96 9.04 2.88 -5.39 12.11 5.08 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 3 3 # 3 B 85 HIS A 68 HIS~? 36.06 O1 FMT A 174 B 171 ARG A 77 ARG~? 44.68 O1 FMT A 174 B 190 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 53.15 0.53 14.80 53.37 -1.51 15.17 coo 2.83 4.83 10.84 1.96 4.32 7.97 66.39 1.10 5.82 67.17 3.11 8.07 coo -8.96 9.04 2.88 -5.39 12.11 5.08 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 4 3 # 4 B 85 HIS A 144 HIS~? 21.24 O2 FMT A 174 B 171 ARG A 109 ARG~? -3.22 O2 FMT A 174s B 190 LYS A 150 LYS~? 21.36 C FMT A 174 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 2.83 4.83 10.84 1.96 4.32 7.97 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo -8.96 9.04 2.88 -5.39 12.11 5.08 10.40 -5.89 -12.34 6.45 -10.45 -13.59 1azy_c01 source 1azy THYMIDINE PHOSPHORYLASE : 4 hits 1azy_c01 naa= 3 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 1 3 # 1 A 88 PHE A 71 PHE~? 40.66 O1 FMT A 174 A 159 ASP A 78 ASP~? 43.27 O2 FMT A 175 A 188 LYS A 51 LYS~? 41.76 O1 FMT A 175 coo 13.91 34.58 14.67 12.95 36.00 12.47 58.85 0.67 14.70 59.61 -1.88 15.79 coo 20.97 28.40 16.26 20.19 30.15 15.34 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 22.55 41.65 15.60 18.92 37.20 14.63 55.36 -8.57 15.97 57.03 -6.97 21.56 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 2 3 # 2 A 88 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 159 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 188 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 13.91 34.58 14.67 12.95 36.00 12.47 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 20.97 28.40 16.26 20.19 30.15 15.34 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 22.55 41.65 15.60 18.92 37.20 14.63 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 3 3 # 3 A 88 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 159 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 188 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 13.91 34.58 14.67 12.95 36.00 12.47 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 20.97 28.40 16.26 20.19 30.15 15.34 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 22.55 41.65 15.60 18.92 37.20 14.63 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 3 hits 1b9h_c02 naa= 3 ULMN 3 1bbs_c06 RENIN user 1 3 # 1 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 35 SER A 94 SER~? 15.65 O2 FMT A 175 215 ASP A 89 ASP~? 23.36 C FMT A 176 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 66.00 46.17 80.29 64.31 47.92 79.91 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 63.61 40.10 74.06 64.05 42.07 74.70 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1bbs_c06 source 1bbs RENIN : 1 hits 1bbs_c06 naa= 3 ULMN 3 1bbs_c07 RENIN user 1 3 # 1 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 35 SER A 94 SER~? 15.65 O2 FMT A 175 215 ASP A 89 ASP~? 23.36 C FMT A 176 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 66.00 46.17 80.29 64.31 47.92 79.91 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 63.61 40.10 74.06 64.05 42.07 74.70 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1bbs_c07 source 1bbs RENIN : 1 hits 1bbs_c07 naa= 3 ULMN 3 1bf2_c00 ISOAMYLASE user 1 3 # 1 375 ASP A 166 ASP~? 5.39 O2 FMT A 176 435 GLU A 167 GLU~? -4.28 O1 FMT A 176s 510 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 88.62 69.90 41.16 89.05 70.67 43.04 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 89.52 76.11 40.17 89.01 75.16 41.97 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 84.89 77.60 46.67 85.63 75.79 46.03 29.91 -28.16 -19.91 31.33 -29.73 -20.56 1bf2_c00 source 1bf2 ISOAMYLASE : 1 hits 1bf2_c00 naa= 3 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 1 3 # 1 28 GLU A 55 GLU~? 39.06 O1 FMT A 174 70 HIS A 59 HIS~? 37.22 O1 FMT A 174 281 HIS A 103 HIS~? 8.30 O2 FMT A 174 coo 66.09 46.17 155.81 66.77 48.19 155.70 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 69.05 50.55 157.03 68.00 52.29 156.51 50.17 1.75 17.58 51.60 1.04 18.95 coo 100.93 36.73 156.02 100.47 38.42 157.18 35.22 -6.46 -14.60 35.44 -5.32 -12.85 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 2 3 # 2 28 GLU A 55 GLU~? 39.06 O1 FMT A 174 70 HIS A 68 HIS~? 36.06 O1 FMT A 174 281 HIS A 103 HIS~? 8.30 O2 FMT A 174 coo 66.09 46.17 155.81 66.77 48.19 155.70 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 69.05 50.55 157.03 68.00 52.29 156.51 53.15 0.53 14.80 53.37 -1.51 15.17 coo 100.93 36.73 156.02 100.47 38.42 157.18 35.22 -6.46 -14.60 35.44 -5.32 -12.85 1bfd_c00 source 1bfd BENZOYLFORMATE DECARBOXYLASE : 2 hits 1bfd_c00 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 167 GLU~? -4.28 O1 FMT A 176s A 503 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 537 GLU A 164 GLU~? 5.82 O1 FMT A 175 coo 24.06 146.21 11.09 22.89 146.18 9.36 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 15.91 140.69 8.32 15.71 143.39 9.13 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 16.65 144.44 13.24 18.34 145.22 12.33 27.84 -22.33 -10.08 25.81 -22.69 -9.75 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 1 hits 1bgl_c08 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 451 GLU A 167 GLU~? -4.28 O1 FMT A 176s A 540 GLU A 164 GLU~? 5.82 O1 FMT A 175 coo 79.04 80.20 80.81 79.58 81.40 83.63 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 81.34 87.29 87.22 82.36 86.09 88.61 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 79.94 80.46 88.84 81.11 81.36 87.27 27.84 -22.33 -10.08 25.81 -22.69 -9.75 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 163 ARG~? 6.61 O2 FMT A 175 B 451 GLU A 167 GLU~? -4.28 O1 FMT A 176s B 540 GLU A 164 GLU~? 5.82 O1 FMT A 175 coo 82.21 41.07 119.14 83.95 40.66 116.59 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 86.52 35.28 112.74 87.08 36.38 110.99 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 83.38 41.19 112.55 85.47 40.59 112.72 27.84 -22.33 -10.08 25.81 -22.69 -9.75 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c05 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG A 67 ARG~? 43.16 O1 FMT A 174 183 LYS A 58 LYS~? 34.16 O1 FMT A 174 317 ARG A 31 ARG~? 22.01 O1 FMT A 174 coo 76.57 109.19 73.41 73.86 110.26 72.16 57.57 5.82 16.12 60.39 6.14 14.88 coo 82.09 117.51 66.37 80.60 114.32 71.44 46.48 -1.26 18.71 47.01 -6.34 18.98 coo 65.21 120.62 58.76 63.62 123.14 59.66 48.96 -3.53 -0.04 48.31 -5.49 -2.36 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 2 3 # 2 118 ARG A 67 ARG~? 43.16 O1 FMT A 174 183 LYS A 58 LYS~? 34.16 O1 FMT A 174 317 ARG A 50 ARG~? 30.44 C FMT A 175 coo 76.57 109.19 73.41 73.86 110.26 72.16 57.57 5.82 16.12 60.39 6.14 14.88 coo 82.09 117.51 66.37 80.60 114.32 71.44 46.48 -1.26 18.71 47.01 -6.34 18.98 coo 65.21 120.62 58.76 63.62 123.14 59.66 56.17 -13.83 11.47 55.95 -14.59 8.45 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 3 3 # 3 118 ARG A 101 ARG~? 6.72 O2 FMT A 176 183 LYS A 160 LYS~? 7.79 O1 FMT A 175 317 ARG A 132 ARG~? 15.71 O4 PEG A 177 coo 76.57 109.19 73.41 73.86 110.26 72.16 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 82.09 117.51 66.37 80.60 114.32 71.44 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 65.21 120.62 58.76 63.62 123.14 59.66 21.56 -24.77 -26.82 24.40 -25.49 -27.78 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 4 3 # 4 118 ARG A 136 ARG~? -19.53 O1 PEG A 177s 183 LYS A 122 LYS~? 10.14 O4 PEG A 177 317 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 76.57 109.19 73.41 73.86 110.26 72.16 16.63 -21.80 -25.68 14.14 -20.50 -26.99 coo 82.09 117.51 66.37 80.60 114.32 71.44 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo 65.21 120.62 58.76 63.62 123.14 59.66 30.03 -15.29 -9.70 32.00 -14.53 -7.50 1bib_c00 source 1bib BIRA BIFUNCTIONAL PROTEIN (ACTS AS BIOTIN OPER: 4 hits 1bib_c00 naa= 3 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 A 82 HIS A 144 HIS~? 21.24 O2 FMT A 174 A 168 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 187 LYS A 150 LYS~? 21.36 C FMT A 174 coo 62.47 12.00 59.65 61.76 10.14 60.31 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 55.10 8.37 73.00 55.48 9.59 70.20 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 66.76 10.09 66.23 61.80 8.06 65.82 10.40 -5.89 -12.34 6.45 -10.45 -13.59 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 A 82 HIS A 144 HIS~? 21.24 O2 FMT A 174 A 168 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 187 LYS A 150 LYS~? 21.36 C FMT A 174 coo 62.47 12.00 59.65 61.76 10.14 60.31 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 55.10 8.37 73.00 55.48 9.59 70.20 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 66.76 10.09 66.23 61.80 8.06 65.82 10.40 -5.89 -12.34 6.45 -10.45 -13.59 1brw_c00 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 2 hits 1brw_c00 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 81 GLN~? 38.84 O1 FMT A 174 A 91 LEU A 28 LEU~? 31.53 O1 FMT A 174 A 133 GLU A 82 GLU~? 33.82 C FMT A 176 coo 43.58 43.67 66.73 42.32 42.78 68.15 62.89 -4.54 1.02 64.71 -3.45 1.05 coo 38.58 45.09 70.44 38.28 45.21 72.59 56.67 -2.02 1.26 57.08 -4.17 1.18 coo 44.05 36.87 70.65 43.15 38.64 69.97 63.56 -8.70 -5.74 65.32 -9.03 -6.89 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 141 GLN~? 18.66 C FMT A 174 A 91 LEU A 138 LEU~? 14.58 C FMT A 174 A 133 GLU A 145 GLU~? 14.25 C FMT A 174 coo 43.58 43.67 66.73 42.32 42.78 68.15 11.94 -17.03 -16.42 12.60 -18.72 -15.19 coo 38.58 45.09 70.44 38.28 45.21 72.59 18.27 -18.18 -16.88 18.67 -19.02 -14.76 coo 44.05 36.87 70.65 43.15 38.64 69.97 12.14 -10.58 -14.19 13.77 -11.35 -13.11 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 141 GLN~? 18.66 C FMT A 174 B 591 LEU A 138 LEU~? 14.58 C FMT A 174 B 633 GLU A 145 GLU~? 14.25 C FMT A 174 coo 88.06 44.34 57.19 89.06 45.53 55.74 11.94 -17.03 -16.42 12.60 -18.72 -15.19 coo 86.70 48.66 52.61 87.15 48.69 50.51 18.27 -18.18 -16.88 18.67 -19.02 -14.76 coo 95.42 44.52 54.43 93.46 45.31 54.70 12.14 -10.58 -14.19 13.77 -11.35 -13.11 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 1 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 81 GLN~? 38.84 O1 FMT A 174 C1091 LEU A 28 LEU~? 31.53 O1 FMT A 174 C1133 GLU A 82 GLU~? 33.82 C FMT A 176 coo 68.29 34.44 43.03 66.67 34.74 44.37 62.89 -4.54 1.02 64.71 -3.45 1.05 coo 65.83 38.95 47.05 65.46 38.90 49.20 56.67 -2.02 1.26 57.08 -4.17 1.18 coo 63.14 29.39 46.25 63.84 31.31 45.74 63.56 -8.70 -5.74 65.32 -9.03 -6.89 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN A 141 GLN~? 18.66 C FMT A 174 C1091 LEU A 138 LEU~? 14.58 C FMT A 174 C1133 GLU A 145 GLU~? 14.25 C FMT A 174 coo 68.29 34.44 43.03 66.67 34.74 44.37 11.94 -17.03 -16.42 12.60 -18.72 -15.19 coo 65.83 38.95 47.05 65.46 38.90 49.20 18.27 -18.18 -16.88 18.67 -19.02 -14.76 coo 63.14 29.39 46.25 63.84 31.31 45.74 12.14 -10.58 -14.19 13.77 -11.35 -13.11 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 81 GLN~? 38.84 O1 FMT A 174 A 91 LEU A 28 LEU~? 31.53 O1 FMT A 174 A 133 GLU A 82 GLU~? 33.82 C FMT A 176 coo 38.23 53.34 67.59 38.84 53.87 69.56 62.89 -4.54 1.02 64.71 -3.45 1.05 coo 35.40 53.22 73.30 35.37 54.87 74.74 56.67 -2.02 1.26 57.08 -4.17 1.18 coo 45.08 56.04 70.60 43.15 55.19 70.77 63.56 -8.70 -5.74 65.32 -9.03 -6.89 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 141 GLN~? 18.66 C FMT A 174 A 91 LEU A 138 LEU~? 14.58 C FMT A 174 A 133 GLU A 145 GLU~? 14.25 C FMT A 174 coo 38.23 53.34 67.59 38.84 53.87 69.56 11.94 -17.03 -16.42 12.60 -18.72 -15.19 coo 35.40 53.22 73.30 35.37 54.87 74.74 18.27 -18.18 -16.88 18.67 -19.02 -14.76 coo 45.08 56.04 70.60 43.15 55.19 70.77 12.14 -10.58 -14.19 13.77 -11.35 -13.11 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 2 hits 1bsj_c00 naa= 3 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 # 1 A 325 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 354 GLU A 167 GLU~? -4.28 O1 FMT A 176s A 421 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 31.05 49.37 64.51 31.97 51.11 63.85 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 29.07 50.42 58.36 29.02 52.18 59.49 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 30.82 59.76 58.47 31.12 59.02 60.40 29.91 -28.16 -19.91 31.33 -29.73 -20.56 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 80 ASP~? 35.02 C FMT A 176 B 354 GLU A 82 GLU~? 33.82 C FMT A 176 B 421 ASP A 89 ASP~? 23.36 C FMT A 176 coo 25.90 8.19 53.87 25.36 6.97 52.29 64.20 -10.93 1.69 64.86 -11.65 -0.10 coo 27.87 10.66 47.95 27.82 8.60 48.27 63.56 -8.70 -5.74 65.32 -9.03 -6.89 coo 26.02 1.87 43.38 25.90 1.97 45.49 54.15 -9.18 -8.18 53.50 -9.22 -10.26 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 2 3 # 2 B 325 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 354 GLU A 164 GLU~? 5.82 O1 FMT A 175 B 421 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 25.90 8.19 53.87 25.36 6.97 52.29 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 27.87 10.66 47.95 27.82 8.60 48.27 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 26.02 1.87 43.38 25.90 1.97 45.49 29.91 -28.16 -19.91 31.33 -29.73 -20.56 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 3 3 # 3 B 325 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 354 GLU A 167 GLU~? -4.28 O1 FMT A 176s B 421 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 25.90 8.19 53.87 25.36 6.97 52.29 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 27.87 10.66 47.95 27.82 8.60 48.27 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 26.02 1.87 43.38 25.90 1.97 45.49 29.91 -28.16 -19.91 31.33 -29.73 -20.56 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 3 hits 1bvz_c09 naa= 3 ULMN 3 1c54_c00 RIBONUCLEASE SA user 1 3 # 1 A 54 GLU A 30 GLU~? 28.79 O1 FMT A 174 A 65 ARG A 65 ARG~? 29.62 O1 FMT A 174 A 85 HIS A 68 HIS~? 36.06 O1 FMT A 174 coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 50.95 1.74 4.18 49.94 3.63 4.45 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 47.05 3.71 11.47 47.46 0.69 10.93 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 53.15 0.53 14.80 53.37 -1.51 15.17 1c54_c00 source 1c54 RIBONUCLEASE SA : 1 hits 1c54_c00 naa= 3 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 # 1 A 14 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 16 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 67 GLY A 29 GLY~? 31.67 O1 FMT A 174 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 54.21 2.61 0.04 53.68 4.66 -0.22 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 55.99 7.84 0.02 53.99 8.09 0.60 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 55.06 -1.63 5.08 54.44 -1.45 4.54 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 # 2 A 14 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 16 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 67 GLY A 73 GLY~? 37.04 O1 FMT A 174 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 54.21 2.61 0.04 53.68 4.66 -0.22 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 55.99 7.84 0.02 53.99 8.09 0.60 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 59.22 1.39 7.46 59.46 0.96 8.10 1cb7_c06 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c06 naa= 3 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 # 1 C 14 ASP A 27 ASP~? 30.54 O1 FMT A 174 C 16 HIS A 23 HIS~? 33.32 O1 FMT A 174 C 67 GLY A 29 GLY~? 31.67 O1 FMT A 174 coo 10.04 44.27 88.44 9.47 42.32 89.03 54.21 2.61 0.04 53.68 4.66 -0.22 coo 6.38 39.80 88.71 6.88 38.89 86.87 55.99 7.84 0.02 53.99 8.09 0.60 coo 17.63 42.50 89.25 18.11 42.29 88.64 55.06 -1.63 5.08 54.44 -1.45 4.54 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 # 2 C 14 ASP A 27 ASP~? 30.54 O1 FMT A 174 C 16 HIS A 23 HIS~? 33.32 O1 FMT A 174 C 67 GLY A 73 GLY~? 37.04 O1 FMT A 174 coo 10.04 44.27 88.44 9.47 42.32 89.03 54.21 2.61 0.04 53.68 4.66 -0.22 coo 6.38 39.80 88.71 6.88 38.89 86.87 55.99 7.84 0.02 53.99 8.09 0.60 coo 17.63 42.50 89.25 18.11 42.29 88.64 59.22 1.39 7.46 59.46 0.96 8.10 1cb7_c07 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c07 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 119 ASP~? 7.68 O1 PEG A 177 264 GLU A 145 GLU~? 14.25 C FMT A 174 328 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo 45.62 80.42 43.69 45.65 82.01 45.07 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 59.69 92.71 39.85 58.53 92.03 41.47 12.14 -10.58 -14.19 13.77 -11.35 -13.11 coo 45.39 90.72 40.63 45.07 89.14 41.90 25.17 -6.99 -19.79 25.21 -6.55 -17.70 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 166 ASP~? 5.39 O2 FMT A 176 264 GLU A 121 GLU~? 15.09 C1 PEG A 177 328 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 45.62 80.42 43.69 45.65 82.01 45.07 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 59.69 92.71 39.85 58.53 92.03 41.47 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 45.39 90.72 40.63 45.07 89.14 41.90 29.91 -28.16 -19.91 31.33 -29.73 -20.56 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 2 hits 1cdg_c00 naa= 3 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 1 3 # 1 34 ASP A 92 ASP~? 21.45 O1 FMT A 174 37 SER A 94 SER~? 15.65 O2 FMT A 175 216 ASP A 89 ASP~? 23.36 C FMT A 176 coo 16.90 26.20 29.49 16.22 24.50 28.41 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 12.23 24.31 30.40 14.55 23.96 31.03 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 13.93 25.52 22.10 14.75 24.44 23.75 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1cms_c04 source 1cms CHYMOSIN B (FORMERLY KNOWN AS RENNIN) (E.C.3.4: 1 hits 1cms_c04 naa= 3 ULMN 3 1coy_c00 CHOLESTEROL OXIDASE (E.C.1.1.3.6) COuser 1 3 # 1 361 GLU A 100 GLU~? 11.75 C4 PEG A 177 447 HIS A 103 HIS~? 8.30 O2 FMT A 174 485 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo -7.99 19.51 30.67 -8.74 17.98 29.42 41.90 -9.49 -16.18 43.86 -10.09 -17.17 coo -15.81 17.12 25.99 -13.91 16.92 26.88 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo -13.17 13.85 30.36 -11.76 15.41 30.53 35.06 -12.01 -19.02 34.43 -13.28 -20.72 1coy_c00 source 1coy CHOLESTEROL OXIDASE (E.C.1.1.3.6) COMPLEX WITH: 1 hits 1coy_c00 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 127 TYR~? 5.76 O2 FMT A 176 A 173 ASP A 129 ASP~? 7.83 O1 FMT A 176 C 48 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 24.35 4.55 25.11 25.94 3.23 25.53 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 39.00 -16.21 -14.42 38.67 -18.83 -12.88 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 101 ARG~? 6.72 O2 FMT A 176 C 101 TYR A 127 TYR~? 5.76 O2 FMT A 176 C 173 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 32.27 5.62 48.15 31.93 6.48 51.06 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 29.64 3.64 57.39 31.22 5.14 55.65 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 29.91 -28.16 -19.91 31.33 -29.73 -20.56 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 127 TYR~? 5.76 O2 FMT A 176 B 173 ASP A 129 ASP~? 7.83 O1 FMT A 176 D 48 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 39.00 -16.21 -14.42 38.67 -18.83 -12.88 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 A 166 ASP~? 5.39 O2 FMT A 176 A 340 GLU A 167 GLU~? -4.28 O1 FMT A 176s A 395 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 29.91 -28.16 -19.91 31.33 -29.73 -20.56 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 129 ASP~? 7.83 O1 FMT A 176 A 56 ILE A 162 ILE~? 10.17 C2 PEG A 177 A 82 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 27.54 -17.43 -16.55 26.87 -16.28 -17.21 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 23.82 -21.26 -14.80 24.13 -23.57 -16.35 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 56 ILE A 162 ILE~? 10.17 C2 PEG A 177 A 82 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 27.54 -17.43 -16.55 26.87 -16.28 -17.21 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 # 3 A 37 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 56 ILE A 158 ILE~? 10.62 C FMT A 174 A 82 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 21.81 -14.91 -15.86 21.31 -14.74 -17.13 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 23.82 -21.26 -14.80 24.13 -23.57 -16.35 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 3 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 129 ASP~? 7.83 O1 FMT A 176 B 56 ILE A 162 ILE~? 10.17 C2 PEG A 177 B 82 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 27.54 -17.43 -16.55 26.87 -16.28 -17.21 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 23.82 -21.26 -14.80 24.13 -23.57 -16.35 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 56 ILE A 162 ILE~? 10.17 C2 PEG A 177 B 82 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 27.54 -17.43 -16.55 26.87 -16.28 -17.21 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 # 3 B 37 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 56 ILE A 158 ILE~? 10.62 C FMT A 174 B 82 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 21.81 -14.91 -15.86 21.31 -14.74 -17.13 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 23.82 -21.26 -14.80 24.13 -23.57 -16.35 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 3 hits 1d6o_c01 naa= 3 ULMN 3 1d7r_c01 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 138 TRP A 108 TRP~? -4.03 C1 PEG A 177s A 243 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 272 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 18.21 54.75 18.05 19.91 55.17 21.59 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 16.93 55.67 9.65 17.16 54.23 11.19 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 14.13 45.79 13.40 14.25 49.41 18.30 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1d7r_c01 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 1 hits 1d7r_c01 naa= 3 ULMN 3 1db3_c01 GDP-MANNOSE 4,6-DEHYDRATASE user 1 3 # 1 A 132 THR A 154 THR~? 13.94 C FMT A 174 A 156 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 160 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 10.50 56.87 17.73 11.24 57.93 19.43 16.81 -13.43 -12.67 15.47 -14.73 -13.80 coo 11.64 63.07 23.95 11.76 62.47 21.20 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 5.78 61.30 21.65 8.04 62.89 17.54 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1db3_c01 source 1db3 GDP-MANNOSE 4,6-DEHYDRATASE : 1 hits 1db3_c01 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS A 59 HIS~? 37.22 O1 FMT A 174 A 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 A 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo 1.13 77.49 40.64 0.62 75.57 39.98 50.17 1.75 17.58 51.60 1.04 18.95 coo 0.84 91.24 49.01 2.91 91.61 49.23 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 10.53 97.56 43.71 9.33 93.71 47.17 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 A 123 HIS A 68 HIS~? 36.06 O1 FMT A 174 A 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 A 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo 1.13 77.49 40.64 0.62 75.57 39.98 53.15 0.53 14.80 53.37 -1.51 15.17 coo 0.84 91.24 49.01 2.91 91.61 49.23 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 10.53 97.56 43.71 9.33 93.71 47.17 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 A 123 HIS A 103 HIS~? 8.30 O2 FMT A 174 A 200 ASP A 92 ASP~? 21.45 O1 FMT A 174 A 229 LYS A 36 LYS~? 16.87 O1 FMT A 175 coo 1.13 77.49 40.64 0.62 75.57 39.98 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 0.84 91.24 49.01 2.91 91.61 49.23 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 10.53 97.56 43.71 9.33 93.71 47.17 45.50 -12.01 6.04 40.69 -15.39 4.67 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 A 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 A 200 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 1.13 77.49 40.64 0.62 75.57 39.98 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 0.84 91.24 49.01 2.91 91.61 49.23 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 10.53 97.56 43.71 9.33 93.71 47.17 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 A 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 A 200 ASP A 116 ASP~? 12.69 O1 PEG A 177 A 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 1.13 77.49 40.64 0.62 75.57 39.98 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 0.84 91.24 49.01 2.91 91.61 49.23 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 10.53 97.56 43.71 9.33 93.71 47.17 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1dfo_c12 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 5 hits 1dfo_c12 naa= 3 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 123 HIS A 59 HIS~? 37.22 O1 FMT A 174 B 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 B 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo 9.24 94.26 88.22 8.02 94.07 89.92 50.17 1.75 17.58 51.60 1.04 18.95 coo 17.54 90.31 75.01 17.17 92.01 73.80 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 22.32 101.61 71.64 17.89 98.63 71.55 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 B 123 HIS A 68 HIS~? 36.06 O1 FMT A 174 B 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 B 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo 9.24 94.26 88.22 8.02 94.07 89.92 53.15 0.53 14.80 53.37 -1.51 15.17 coo 17.54 90.31 75.01 17.17 92.01 73.80 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 22.32 101.61 71.64 17.89 98.63 71.55 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 B 123 HIS A 103 HIS~? 8.30 O2 FMT A 174 B 200 ASP A 92 ASP~? 21.45 O1 FMT A 174 B 229 LYS A 36 LYS~? 16.87 O1 FMT A 175 coo 9.24 94.26 88.22 8.02 94.07 89.92 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 17.54 90.31 75.01 17.17 92.01 73.80 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 22.32 101.61 71.64 17.89 98.63 71.55 45.50 -12.01 6.04 40.69 -15.39 4.67 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 B 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 B 200 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 9.24 94.26 88.22 8.02 94.07 89.92 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 17.54 90.31 75.01 17.17 92.01 73.80 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 22.32 101.61 71.64 17.89 98.63 71.55 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 B 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 B 200 ASP A 116 ASP~? 12.69 O1 PEG A 177 B 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 9.24 94.26 88.22 8.02 94.07 89.92 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 17.54 90.31 75.01 17.17 92.01 73.80 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 22.32 101.61 71.64 17.89 98.63 71.55 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1dfo_c13 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 5 hits 1dfo_c13 naa= 3 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 123 HIS A 59 HIS~? 37.22 O1 FMT A 174 C 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 C 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo 26.77 65.84 83.49 27.06 67.76 84.27 50.17 1.75 17.58 51.60 1.04 18.95 coo 19.52 52.01 79.59 20.28 51.65 77.65 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 28.90 45.91 73.55 25.22 49.72 72.97 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 C 123 HIS A 68 HIS~? 36.06 O1 FMT A 174 C 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 C 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo 26.77 65.84 83.49 27.06 67.76 84.27 53.15 0.53 14.80 53.37 -1.51 15.17 coo 19.52 52.01 79.59 20.28 51.65 77.65 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 28.90 45.91 73.55 25.22 49.72 72.97 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 C 123 HIS A 103 HIS~? 8.30 O2 FMT A 174 C 200 ASP A 92 ASP~? 21.45 O1 FMT A 174 C 229 LYS A 36 LYS~? 16.87 O1 FMT A 175 coo 26.77 65.84 83.49 27.06 67.76 84.27 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 19.52 52.01 79.59 20.28 51.65 77.65 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 28.90 45.91 73.55 25.22 49.72 72.97 45.50 -12.01 6.04 40.69 -15.39 4.67 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 C 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 C 200 ASP A 110 ASP~? 7.00 O2 FMT A 174 C 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 26.77 65.84 83.49 27.06 67.76 84.27 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 19.52 52.01 79.59 20.28 51.65 77.65 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 28.90 45.91 73.55 25.22 49.72 72.97 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 C 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 C 200 ASP A 116 ASP~? 12.69 O1 PEG A 177 C 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 26.77 65.84 83.49 27.06 67.76 84.27 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 19.52 52.01 79.59 20.28 51.65 77.65 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 28.90 45.91 73.55 25.22 49.72 72.97 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1dfo_c14 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 5 hits 1dfo_c14 naa= 3 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 123 HIS A 59 HIS~? 37.22 O1 FMT A 174 D 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 D 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo -10.90 48.74 53.41 -12.98 48.90 53.67 50.17 1.75 17.58 51.60 1.04 18.95 coo 4.60 52.95 52.50 5.57 51.29 53.40 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 10.05 41.79 49.80 7.94 44.71 53.76 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 D 123 HIS A 68 HIS~? 36.06 O1 FMT A 174 D 200 ASP A 47 ASP~? 38.21 O1 FMT A 175 D 229 LYS A 42 LYS.? 22.49 C FMT A 175 coo -10.90 48.74 53.41 -12.98 48.90 53.67 53.15 0.53 14.80 53.37 -1.51 15.17 coo 4.60 52.95 52.50 5.57 51.29 53.40 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 10.05 41.79 49.80 7.94 44.71 53.76 54.15 -17.47 3.60 51.97 -21.51 1.29 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 D 123 HIS A 103 HIS~? 8.30 O2 FMT A 174 D 200 ASP A 92 ASP~? 21.45 O1 FMT A 174 D 229 LYS A 36 LYS~? 16.87 O1 FMT A 175 coo -10.90 48.74 53.41 -12.98 48.90 53.67 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 4.60 52.95 52.50 5.57 51.29 53.40 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 10.05 41.79 49.80 7.94 44.71 53.76 45.50 -12.01 6.04 40.69 -15.39 4.67 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 D 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 D 200 ASP A 110 ASP~? 7.00 O2 FMT A 174 D 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -10.90 48.74 53.41 -12.98 48.90 53.67 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 4.60 52.95 52.50 5.57 51.29 53.40 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 10.05 41.79 49.80 7.94 44.71 53.76 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 D 123 HIS A 144 HIS~? 21.24 O2 FMT A 174 D 200 ASP A 116 ASP~? 12.69 O1 PEG A 177 D 229 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo -10.90 48.74 53.41 -12.98 48.90 53.67 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 4.60 52.95 52.50 5.57 51.29 53.40 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 10.05 41.79 49.80 7.94 44.71 53.76 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 5 hits 1dfo_c15 naa= 3 ULMN 3 1dhp_c02 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 A 44 THR A 33 THR~? 28.47 O1 FMT A 174 A 45 THR A 34 THR.? 22.77 O1 FMT A 174 A 161 LYS A 51 LYS~? 41.76 O1 FMT A 175 coo 26.16 88.25 79.16 25.22 89.47 80.71 49.26 -4.38 7.66 49.26 -2.31 8.35 coo 27.73 89.90 76.08 29.24 91.46 75.95 46.37 -5.07 5.30 46.04 -3.92 3.46 coo 33.83 91.15 88.62 31.07 91.06 83.02 55.36 -8.57 15.97 57.03 -6.97 21.56 ULMN 3 1dhp_c02 DIHYDRODIPICOLINATE SYNTHASE user 2 3 # 2 A 44 THR A 33 THR~? 28.47 O1 FMT A 174 A 45 THR A 34 THR.? 22.77 O1 FMT A 174 A 161 LYS A 58 LYS~? 34.16 O1 FMT A 174 coo 26.16 88.25 79.16 25.22 89.47 80.71 49.26 -4.38 7.66 49.26 -2.31 8.35 coo 27.73 89.90 76.08 29.24 91.46 75.95 46.37 -5.07 5.30 46.04 -3.92 3.46 coo 33.83 91.15 88.62 31.07 91.06 83.02 46.48 -1.26 18.71 47.01 -6.34 18.98 ULMN 3 1dhp_c02 DIHYDRODIPICOLINATE SYNTHASE user 3 3 # 3 A 44 THR A 33 THR~? 28.47 O1 FMT A 174 A 45 THR A 34 THR.? 22.77 O1 FMT A 174 A 161 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 26.16 88.25 79.16 25.22 89.47 80.71 49.26 -4.38 7.66 49.26 -2.31 8.35 coo 27.73 89.90 76.08 29.24 91.46 75.95 46.37 -5.07 5.30 46.04 -3.92 3.46 coo 33.83 91.15 88.62 31.07 91.06 83.02 52.34 7.32 12.03 54.08 9.90 7.62 1dhp_c02 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 3 hits 1dhp_c02 naa= 3 ULMN 3 1dhp_c03 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 B 44 THR A 33 THR~? 28.47 O1 FMT A 174 B 45 THR A 34 THR.? 22.77 O1 FMT A 174 B 161 LYS A 51 LYS~? 41.76 O1 FMT A 175 coo 7.39 128.28 94.56 8.34 126.36 94.79 49.26 -4.38 7.66 49.26 -2.31 8.35 coo 5.75 129.25 91.25 4.29 128.16 90.07 46.37 -5.07 5.30 46.04 -3.92 3.46 coo -0.17 119.75 99.65 2.51 123.83 95.70 55.36 -8.57 15.97 57.03 -6.97 21.56 ULMN 3 1dhp_c03 DIHYDRODIPICOLINATE SYNTHASE user 2 3 # 2 B 44 THR A 33 THR~? 28.47 O1 FMT A 174 B 45 THR A 34 THR.? 22.77 O1 FMT A 174 B 161 LYS A 58 LYS~? 34.16 O1 FMT A 174 coo 7.39 128.28 94.56 8.34 126.36 94.79 49.26 -4.38 7.66 49.26 -2.31 8.35 coo 5.75 129.25 91.25 4.29 128.16 90.07 46.37 -5.07 5.30 46.04 -3.92 3.46 coo -0.17 119.75 99.65 2.51 123.83 95.70 46.48 -1.26 18.71 47.01 -6.34 18.98 ULMN 3 1dhp_c03 DIHYDRODIPICOLINATE SYNTHASE user 3 3 # 3 B 44 THR A 33 THR~? 28.47 O1 FMT A 174 B 45 THR A 34 THR.? 22.77 O1 FMT A 174 B 161 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 7.39 128.28 94.56 8.34 126.36 94.79 49.26 -4.38 7.66 49.26 -2.31 8.35 coo 5.75 129.25 91.25 4.29 128.16 90.07 46.37 -5.07 5.30 46.04 -3.92 3.46 coo -0.17 119.75 99.65 2.51 123.83 95.70 52.34 7.32 12.03 54.08 9.90 7.62 1dhp_c03 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 3 hits 1dhp_c03 naa= 3 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 1 3 # 1 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 150 LYS A 157 LYS~? 15.32 C FMT A 174 186 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo 32.88 50.55 24.33 31.89 51.78 26.65 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 27.04 52.42 22.30 26.88 49.99 27.00 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 36.98 50.30 37.29 35.85 50.29 35.50 35.06 -12.01 -19.02 34.43 -13.28 -20.72 1dhr_c00 source 1dhr DIHYDROPTERIDINE REDUCTASE (DHPR) (E.C.1.6.99.: 1 hits 1dhr_c00 naa= 3 ULMN 3 1do8_c00 MALIC ENZYME user 1 3 # 1 A 112 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 183 LYS A 160 LYS~? 7.79 O1 FMT A 175 A 278 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 19.43 18.53 42.32 17.66 18.80 40.15 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 21.92 15.80 36.19 17.64 19.44 36.35 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 15.46 19.03 31.40 15.01 18.25 33.31 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1do8_c00 source 1do8 MALIC ENZYME : 1 hits 1do8_c00 naa= 3 ULMN 3 1do8_c01 MALIC ENZYME user 1 3 # 1 B 112 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 183 LYS A 160 LYS~? 7.79 O1 FMT A 175 B 278 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 58.62 15.99 58.34 60.98 14.60 58.93 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 60.11 10.60 53.63 62.59 10.74 58.67 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 66.50 7.32 58.45 66.26 9.42 58.23 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1do8_c01 source 1do8 MALIC ENZYME : 1 hits 1do8_c01 naa= 3 ULMN 3 1do8_c02 MALIC ENZYME user 1 3 # 1 C 112 TYR A 161 TYR~? 10.37 O2 FMT A 175 C 183 LYS A 160 LYS~? 7.79 O1 FMT A 175 C 278 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1do8_c02 source 1do8 MALIC ENZYME : 1 hits 1do8_c02 naa= 3 ULMN 3 1do8_c03 MALIC ENZYME user 1 3 # 1 D 112 TYR A 161 TYR~? 10.37 O2 FMT A 175 D 183 LYS A 160 LYS~? 7.79 O1 FMT A 175 D 278 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1do8_c03 source 1do8 MALIC ENZYME : 1 hits 1do8_c03 naa= 3 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 B 131 LYS A 51 LYS~? 41.76 O1 FMT A 175 B 215 LYS A 36 LYS~? 16.87 O1 FMT A 175 B 277 LYS A 42 LYS.? 22.49 C FMT A 175 coo 6.78 45.91 16.15 7.82 40.81 15.84 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 17.88 38.77 19.81 16.38 34.23 17.24 45.50 -12.01 6.04 40.69 -15.39 4.67 coo 20.33 37.78 11.20 16.77 34.53 13.47 54.15 -17.47 3.60 51.97 -21.51 1.29 1e19_c01 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 1 hits 1e19_c01 naa= 3 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 127 TYR~? 5.76 O2 FMT A 176 A 40 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 103 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 29.91 -28.16 -19.91 31.33 -29.73 -20.56 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 40 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 103 ASP A 131 ASP~? 16.41 O2 FMT A 176 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 22.06 -26.63 -18.59 20.10 -27.49 -18.71 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 127 TYR~? 5.76 O2 FMT A 176 B 40 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 103 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 29.91 -28.16 -19.91 31.33 -29.73 -20.56 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 40 ASP A 129 ASP~? 7.83 O1 FMT A 176 B 103 ASP A 131 ASP~? 16.41 O2 FMT A 176 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 22.06 -26.63 -18.59 20.10 -27.49 -18.71 1e3v_c03 source 1e3v STEROID DELTA-ISOMERASE : 2 hits 1e3v_c03 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 A 35 SER A 94 SER~? 15.65 O2 FMT A 175 A 218 ASP A 89 ASP~? 23.36 C FMT A 176 coo 47.22 22.34 8.57 45.16 22.02 9.13 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 43.58 20.85 5.15 44.62 23.01 5.76 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 44.05 16.99 12.67 44.05 18.89 11.74 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1eag_c04 source 1eag PEPTIDE INHIBITOR : 1 hits 1eag_c04 naa= 3 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 1 3 # 1 A 99 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 177 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 203 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 8.74 45.76 47.19 9.33 46.93 45.56 55.99 7.84 0.02 53.99 8.09 0.60 coo 11.68 42.31 52.96 12.05 43.92 51.65 54.21 2.61 0.04 53.68 4.66 -0.22 coo 18.07 52.81 49.62 14.17 49.99 48.07 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 2 3 # 2 A 99 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 177 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 203 LYS A 74 LYS~? 39.82 O1 FMT A 174 coo 8.74 45.76 47.19 9.33 46.93 45.56 55.99 7.84 0.02 53.99 8.09 0.60 coo 11.68 42.31 52.96 12.05 43.92 51.65 54.21 2.61 0.04 53.68 4.66 -0.22 coo 18.07 52.81 49.62 14.17 49.99 48.07 62.62 1.22 9.29 60.96 4.34 8.46 1ecx_c02 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c02 naa= 3 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 1 3 # 1 B 99 HIS A 23 HIS~? 33.32 O1 FMT A 174 B 177 ASP A 27 ASP~? 30.54 O1 FMT A 174 B 203 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 14.87 88.04 21.51 13.64 87.90 19.81 55.99 7.84 0.02 53.99 8.09 0.60 coo 15.87 92.46 27.37 14.46 91.76 25.94 54.21 2.61 0.04 53.68 4.66 -0.22 coo 3.60 91.42 23.52 8.20 89.55 22.63 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 2 3 # 2 B 99 HIS A 23 HIS~? 33.32 O1 FMT A 174 B 177 ASP A 27 ASP~? 30.54 O1 FMT A 174 B 203 LYS A 74 LYS~? 39.82 O1 FMT A 174 coo 14.87 88.04 21.51 13.64 87.90 19.81 55.99 7.84 0.02 53.99 8.09 0.60 coo 15.87 92.46 27.37 14.46 91.76 25.94 54.21 2.61 0.04 53.68 4.66 -0.22 coo 3.60 91.42 23.52 8.20 89.55 22.63 62.62 1.22 9.29 60.96 4.34 8.46 1ecx_c03 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c03 naa= 3 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 3 # 1 P 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 P 35 SER A 94 SER~? 15.65 O2 FMT A 175 P 215 ASP A 89 ASP~? 23.36 C FMT A 176 coo 10.15 33.41 11.98 7.98 33.66 12.07 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 7.57 37.60 10.00 8.86 37.02 12.03 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 4.04 29.97 8.82 4.78 31.15 10.46 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1eed_c04 source 1eed ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLEX WITH TH: 1 hits 1eed_c04 naa= 3 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 A 114 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 197 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 223 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 55.99 7.84 0.02 53.99 8.09 0.60 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 54.21 2.61 0.04 53.68 4.66 -0.22 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 A 114 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 197 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 223 LYS A 74 LYS~? 39.82 O1 FMT A 174 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 55.99 7.84 0.02 53.99 8.09 0.60 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 54.21 2.61 0.04 53.68 4.66 -0.22 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 62.62 1.22 9.29 60.96 4.34 8.46 1elq_c02 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 2 hits 1elq_c02 naa= 3 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 B 114 HIS A 23 HIS~? 33.32 O1 FMT A 174 B 197 ASP A 27 ASP~? 30.54 O1 FMT A 174 B 223 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 55.99 7.84 0.02 53.99 8.09 0.60 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 54.21 2.61 0.04 53.68 4.66 -0.22 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 B 114 HIS A 23 HIS~? 33.32 O1 FMT A 174 B 197 ASP A 27 ASP~? 30.54 O1 FMT A 174 B 223 LYS A 74 LYS~? 39.82 O1 FMT A 174 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 55.99 7.84 0.02 53.99 8.09 0.60 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 54.21 2.61 0.04 53.68 4.66 -0.22 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 62.62 1.22 9.29 60.96 4.34 8.46 1elq_c03 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 2 hits 1elq_c03 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 52 ALA~? 36.86 O1 FMT A 174 A 257 ALA A 48 ALA~? 40.58 O2 FMT A 175 A 328 ASP A 78 ASP~? 43.27 O2 FMT A 175 coo 39.84 24.12 8.44 38.50 24.23 9.11 55.15 -4.93 14.69 56.17 -4.23 13.82 coo 43.22 26.73 5.37 41.81 27.09 5.79 60.35 -8.17 14.75 61.63 -7.26 14.84 coo 38.17 34.10 6.67 37.72 32.06 6.84 65.63 -6.29 9.14 66.97 -5.21 10.41 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA A 54 ALA~? 32.98 O1 FMT A 175 A 257 ALA A 52 ALA~? 36.86 O1 FMT A 174 A 328 ASP A 47 ASP~? 38.21 O1 FMT A 175 coo 39.84 24.12 8.44 38.50 24.23 9.11 50.28 -7.90 14.99 50.63 -9.22 15.77 coo 43.22 26.73 5.37 41.81 27.09 5.79 55.15 -4.93 14.69 56.17 -4.23 13.82 coo 38.17 34.10 6.67 37.72 32.06 6.84 60.78 -12.55 15.33 61.00 -14.73 15.19 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 2 hits 1eo7_c00 naa= 3 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 38 THR A 60 THR.? 33.58 O1 FMT A 174 A 159 LYS A 66 LYS~? 36.30 O1 FMT A 174 A 193 GLU A 30 GLU~? 28.79 O1 FMT A 174 coo -2.58 16.31 54.79 -4.02 14.93 55.64 44.47 4.14 16.86 42.67 4.08 18.25 coo 2.10 10.68 61.44 -2.14 13.16 60.61 52.34 7.32 12.03 54.08 9.90 7.62 coo -5.33 11.71 69.72 -4.62 11.92 67.73 50.95 1.74 4.18 49.94 3.63 4.45 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 38 THR A 154 THR~? 13.94 C FMT A 174 A 159 LYS A 160 LYS~? 7.79 O1 FMT A 175 A 193 GLU A 106 GLU~? -4.32 O2 FMT A 174s coo -2.58 16.31 54.79 -4.02 14.93 55.64 16.81 -13.43 -12.67 15.47 -14.73 -13.80 coo 2.10 10.68 61.44 -2.14 13.16 60.61 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo -5.33 11.71 69.72 -4.62 11.92 67.73 30.43 -7.44 -15.33 30.95 -6.29 -13.59 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 2 hits 1et0_c02 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP A 92 ASP~? 21.45 O1 FMT A 174 260 GLU A 100 GLU~? 11.75 C4 PEG A 177 370 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 41.90 -9.49 -16.18 43.86 -10.09 -17.17 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 38.55 -12.80 -8.86 35.99 -13.04 -7.80 ULMN 3 1euu_c00 SIALIDASE user 2 3 # 2 92 ASP A 119 ASP~? 7.68 O1 PEG A 177 260 GLU A 126 GLU~? 5.29 O4 PEG A 177 370 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 1euu_c00 SIALIDASE user 3 3 # 3 92 ASP A 129 ASP~? 7.83 O1 FMT A 176 260 GLU A 164 GLU~? 5.82 O1 FMT A 175 370 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 23.82 -21.26 -14.80 24.13 -23.57 -16.35 ULMN 3 1euu_c00 SIALIDASE user 4 3 # 4 92 ASP A 166 ASP~? 5.39 O2 FMT A 176 260 GLU A 100 GLU~? 11.75 C4 PEG A 177 370 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 41.90 -9.49 -16.18 43.86 -10.09 -17.17 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1euu_c00 source 1euu SIALIDASE : 4 hits 1euu_c00 naa= 3 ULMN 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 1 3 # 1 A 68 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 74 ASP A 117 ASP~? 15.82 O1 PEG A 177 A 98 GLU A 121 GLU~? 15.09 C1 PEG A 177 coo 17.19 9.05 25.28 15.77 9.98 26.53 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 15.99 8.54 17.36 14.96 7.80 19.05 18.71 -17.67 -30.43 18.68 -19.55 -29.48 coo 16.31 12.85 18.11 16.71 11.79 19.90 23.47 -20.47 -31.08 23.01 -22.26 -29.87 1eyi_c00 source 1eyi FRUCTOSE-1,6-BISPHOSPHATASE : 1 hits 1eyi_c00 naa= 3 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 1 3 # 1 A 156 LYS A 66 LYS~? 36.30 O1 FMT A 174 A 159 HIS A 59 HIS~? 37.22 O1 FMT A 174 A 162 HIS A 68 HIS~? 36.06 O1 FMT A 174 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 52.34 7.32 12.03 54.08 9.90 7.62 coo 29.80 39.37 7.24 28.18 38.06 7.48 50.17 1.75 17.58 51.60 1.04 18.95 coo 30.26 35.04 5.34 28.61 35.92 4.39 53.15 0.53 14.80 53.37 -1.51 15.17 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 2 3 # 2 A 156 LYS A 66 LYS~? 36.30 O1 FMT A 174 A 159 HIS A 68 HIS~? 36.06 O1 FMT A 174 A 162 HIS A 59 HIS~? 37.22 O1 FMT A 174 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 52.34 7.32 12.03 54.08 9.90 7.62 coo 29.80 39.37 7.24 28.18 38.06 7.48 53.15 0.53 14.80 53.37 -1.51 15.17 coo 30.26 35.04 5.34 28.61 35.92 4.39 50.17 1.75 17.58 51.60 1.04 18.95 1f7u_c00 source 1f7u ARGINYL-TRNA SYNTHETASE : 2 hits 1f7u_c00 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE A 102 PHE~? 5.11 C FMT A 174 A 210 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 9.23 46.77 25.11 11.48 48.39 24.76 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 10.51 37.86 19.71 9.07 39.38 20.04 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -1.20 42.34 17.67 3.19 45.13 19.06 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 112 PHE A 102 PHE~? 5.11 C FMT A 174 A 210 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 9.23 46.77 25.11 11.48 48.39 24.76 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 10.51 37.86 19.71 9.07 39.38 20.04 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -1.20 42.34 17.67 3.19 45.13 19.06 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 A 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 210 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 9.23 46.77 25.11 11.48 48.39 24.76 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 10.51 37.86 19.71 9.07 39.38 20.04 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -1.20 42.34 17.67 3.19 45.13 19.06 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 4 3 # 4 A 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 210 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 244 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 9.23 46.77 25.11 11.48 48.39 24.76 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 10.51 37.86 19.71 9.07 39.38 20.04 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -1.20 42.34 17.67 3.19 45.13 19.06 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 5 3 # 5 A 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 210 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 9.23 46.77 25.11 11.48 48.39 24.76 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 10.51 37.86 19.71 9.07 39.38 20.04 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo -1.20 42.34 17.67 3.19 45.13 19.06 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 6 3 # 6 A 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 210 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 244 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 9.23 46.77 25.11 11.48 48.39 24.76 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 10.51 37.86 19.71 9.07 39.38 20.04 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo -1.20 42.34 17.67 3.19 45.13 19.06 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 7 3 # 7 A 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 210 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 9.23 46.77 25.11 11.48 48.39 24.76 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 10.51 37.86 19.71 9.07 39.38 20.04 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -1.20 42.34 17.67 3.19 45.13 19.06 20.67 -15.87 -11.19 14.43 -16.61 -10.33 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 7 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE A 102 PHE~? 5.11 C FMT A 174 B 210 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 8.76 47.85 34.91 11.08 46.36 35.41 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 9.06 56.85 40.30 7.71 55.27 39.90 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -2.38 51.82 41.62 2.07 49.19 40.42 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 112 PHE A 102 PHE~? 5.11 C FMT A 174 B 210 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 8.76 47.85 34.91 11.08 46.36 35.41 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 9.06 56.85 40.30 7.71 55.27 39.90 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -2.38 51.82 41.62 2.07 49.19 40.42 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 B 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 210 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 8.76 47.85 34.91 11.08 46.36 35.41 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 9.06 56.85 40.30 7.71 55.27 39.90 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -2.38 51.82 41.62 2.07 49.19 40.42 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 4 3 # 4 B 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 210 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 244 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 8.76 47.85 34.91 11.08 46.36 35.41 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 9.06 56.85 40.30 7.71 55.27 39.90 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -2.38 51.82 41.62 2.07 49.19 40.42 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 5 3 # 5 B 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 210 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 8.76 47.85 34.91 11.08 46.36 35.41 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 9.06 56.85 40.30 7.71 55.27 39.90 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo -2.38 51.82 41.62 2.07 49.19 40.42 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 6 3 # 6 B 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 210 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 244 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 8.76 47.85 34.91 11.08 46.36 35.41 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 9.06 56.85 40.30 7.71 55.27 39.90 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo -2.38 51.82 41.62 2.07 49.19 40.42 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 7 3 # 7 B 112 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 210 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 244 LYS A 157 LYS~? 15.32 C FMT A 174 coo 8.76 47.85 34.91 11.08 46.36 35.41 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 9.06 56.85 40.30 7.71 55.27 39.90 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -2.38 51.82 41.62 2.07 49.19 40.42 20.67 -15.87 -11.19 14.43 -16.61 -10.33 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 7 hits 1fc4_c03 naa= 3 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 136 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 210 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 244 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 11.28 44.53 18.60 9.91 46.00 19.20 55.99 7.84 0.02 53.99 8.09 0.60 coo 10.51 37.86 19.71 9.07 39.38 20.04 54.21 2.61 0.04 53.68 4.66 -0.22 coo -1.20 42.34 17.67 3.19 45.13 19.06 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 136 HIS A 23 HIS~? 33.32 O1 FMT A 174 A 210 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 244 LYS A 74 LYS~? 39.82 O1 FMT A 174 coo 11.28 44.53 18.60 9.91 46.00 19.20 55.99 7.84 0.02 53.99 8.09 0.60 coo 10.51 37.86 19.71 9.07 39.38 20.04 54.21 2.61 0.04 53.68 4.66 -0.22 coo -1.20 42.34 17.67 3.19 45.13 19.06 62.62 1.22 9.29 60.96 4.34 8.46 1fc4_c04 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c04 naa= 3 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 136 HIS A 23 HIS~? 33.32 O1 FMT A 174 B 210 ASP A 27 ASP~? 30.54 O1 FMT A 174 B 244 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 10.08 50.18 41.78 8.91 48.61 41.04 55.99 7.84 0.02 53.99 8.09 0.60 coo 9.06 56.85 40.30 7.71 55.27 39.90 54.21 2.61 0.04 53.68 4.66 -0.22 coo -2.38 51.82 41.62 2.07 49.19 40.42 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 136 HIS A 23 HIS~? 33.32 O1 FMT A 174 B 210 ASP A 27 ASP~? 30.54 O1 FMT A 174 B 244 LYS A 74 LYS~? 39.82 O1 FMT A 174 coo 10.08 50.18 41.78 8.91 48.61 41.04 55.99 7.84 0.02 53.99 8.09 0.60 coo 9.06 56.85 40.30 7.71 55.27 39.90 54.21 2.61 0.04 53.68 4.66 -0.22 coo -2.38 51.82 41.62 2.07 49.19 40.42 62.62 1.22 9.29 60.96 4.34 8.46 1fc4_c05 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c05 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 142 LEU A 105 LEU~? 8.20 O2 PEG A 177 A 165 LYS A 157 LYS~? 15.32 C FMT A 174 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 31.24 -13.42 -15.66 32.09 -15.44 -15.82 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 A 165 LYS A 157 LYS~? 15.32 C FMT A 174 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 A 165 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1fdy_c00 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c00 naa= 3 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 142 LEU A 105 LEU~? 8.20 O2 PEG A 177 B 165 LYS A 157 LYS~? 15.32 C FMT A 174 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 31.24 -13.42 -15.66 32.09 -15.44 -15.82 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 B 165 LYS A 157 LYS~? 15.32 C FMT A 174 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 B 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 B 165 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 C 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 C 165 LYS A 157 LYS~? 15.32 C FMT A 174 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 C 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 C 165 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 25.45 -16.84 -10.59 23.78 -19.75 -6.08 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 161 TYR~? 10.37 O2 FMT A 175 D 142 LEU A 105 LEU~? 8.20 O2 PEG A 177 D 165 LYS A 157 LYS~? 15.32 C FMT A 174 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 31.24 -13.42 -15.66 32.09 -15.44 -15.82 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 D 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 D 165 LYS A 157 LYS~? 15.32 C FMT A 174 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 D 137 TYR A 161 TYR~? 10.37 O2 FMT A 175 D 142 LEU A 112 LEU~? 8.73 O1 PEG A 177 D 165 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c03 naa= 3 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 1 3 # 1 A 54 ASP A 92 ASP~? 21.45 O1 FMT A 174 A 281 ARG A 96 ARG~? 20.74 C4 PEG A 177 A 289 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 54.86 40.00 47.23 55.57 38.60 48.67 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 52.08 40.18 50.14 50.83 38.93 47.73 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 57.82 31.70 50.73 57.94 34.00 49.17 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1foh_c00 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c00 naa= 3 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 1 3 # 1 B 54 ASP A 92 ASP~? 21.45 O1 FMT A 174 B 281 ARG A 96 ARG~? 20.74 C4 PEG A 177 B 289 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 90.56 80.24 98.04 90.36 81.53 96.34 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 86.62 80.67 97.51 87.37 82.00 100.10 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 91.83 88.28 92.88 92.60 85.93 94.14 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1foh_c01 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c01 naa= 3 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 1 3 # 1 C 54 ASP A 92 ASP~? 21.45 O1 FMT A 174 C 281 ARG A 96 ARG~? 20.74 C4 PEG A 177 C 289 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 42.34 76.83 49.10 43.06 78.59 50.01 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 46.12 77.15 48.13 44.44 77.61 45.70 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 42.69 86.18 51.69 41.59 83.63 51.54 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1foh_c02 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c02 naa= 3 ULMN 3 1foh_c03 PHENOL HYDROXYLASE user 1 3 # 1 D 54 ASP A 92 ASP~? 21.45 O1 FMT A 174 D 281 ARG A 96 ARG~? 20.74 C4 PEG A 177 D 289 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 75.05 45.80 106.18 74.73 43.88 105.51 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 78.52 44.93 104.78 78.72 44.49 107.76 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 72.35 36.51 104.82 72.00 39.20 105.46 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1foh_c03 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c03 naa= 3 ULMN 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 A 317 GLU A 121 GLU~? 15.09 C1 PEG A 177 A 319 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 359 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 14.41 12.40 16.42 12.92 13.74 15.71 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 12.25 13.04 23.85 11.56 15.02 23.93 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 10.89 14.95 28.28 12.39 12.53 29.31 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 # 2 A 317 GLU A 164 GLU~? 5.82 O1 FMT A 175 A 319 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 359 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 14.41 12.40 16.42 12.92 13.74 15.71 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 12.25 13.04 23.85 11.56 15.02 23.93 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 10.89 14.95 28.28 12.39 12.53 29.31 39.00 -16.21 -14.42 38.67 -18.83 -12.88 1fr8_c00 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 2 hits 1fr8_c00 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU A 106 GLU~? -4.32 O2 FMT A 174s B 319 ASP A 110 ASP~? 7.00 O2 FMT A 174 B 359 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 10.77 13.13 40.94 11.03 14.73 39.51 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 3.77 12.64 38.21 3.35 14.53 37.39 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo -1.16 15.32 35.60 -3.32 13.56 36.98 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 # 2 B 317 GLU A 121 GLU~? 15.09 C1 PEG A 177 B 319 ASP A 119 ASP~? 7.68 O1 PEG A 177 B 359 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 10.77 13.13 40.94 11.03 14.73 39.51 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 3.77 12.64 38.21 3.35 14.53 37.39 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo -1.16 15.32 35.60 -3.32 13.56 36.98 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 3 3 # 3 B 317 GLU A 164 GLU~? 5.82 O1 FMT A 175 B 319 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 359 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 10.77 13.13 40.94 11.03 14.73 39.51 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 3.77 12.64 38.21 3.35 14.53 37.39 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -1.16 15.32 35.60 -3.32 13.56 36.98 39.00 -16.21 -14.42 38.67 -18.83 -12.88 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 3 hits 1fr8_c01 naa= 3 ULMN 3 1fuq_c00 FUMARASE C user 1 3 # 1 A 324 LYS A 66 LYS~? 36.30 O1 FMT A 174 A 331 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 188 HIS A 59 HIS~? 37.22 O1 FMT A 174 coo 130.22 155.23 83.49 125.21 153.71 84.04 52.34 7.32 12.03 54.08 9.90 7.62 coo 120.90 152.23 75.28 120.94 153.09 77.19 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 122.04 152.80 81.06 120.71 154.37 81.46 50.17 1.75 17.58 51.60 1.04 18.95 ULMN 3 1fuq_c00 FUMARASE C user 2 3 # 2 A 324 LYS A 66 LYS~? 36.30 O1 FMT A 174 A 331 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 188 HIS A 68 HIS~? 36.06 O1 FMT A 174 coo 130.22 155.23 83.49 125.21 153.71 84.04 52.34 7.32 12.03 54.08 9.90 7.62 coo 120.90 152.23 75.28 120.94 153.09 77.19 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 122.04 152.80 81.06 120.71 154.37 81.46 53.15 0.53 14.80 53.37 -1.51 15.17 1fuq_c00 source 1fuq FUMARASE C : 2 hits 1fuq_c00 naa= 3 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 1 3 # 1 A 314 TRP A 108 TRP~? -4.03 C1 PEG A 177s A 317 GLU A 126 GLU~? 5.29 O4 PEG A 177 A 365 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 79.91 26.87 38.77 78.95 23.18 37.81 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 85.55 26.30 41.25 85.59 24.97 39.65 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 83.47 25.30 27.10 83.44 27.82 25.29 39.00 -16.21 -14.42 38.67 -18.83 -12.88 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 2 3 # 2 A 314 TRP A 108 TRP~? -4.03 C1 PEG A 177s A 317 GLU A 126 GLU~? 5.29 O4 PEG A 177 A 365 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 79.91 26.87 38.77 78.95 23.18 37.81 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 85.55 26.30 41.25 85.59 24.97 39.65 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 83.47 25.30 27.10 83.44 27.82 25.29 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1g8o_c01 source 1g8o N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALACTOSYLTRA: 2 hits 1g8o_c01 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 164 GLU~? 5.82 O1 FMT A 175 A 47 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 161 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 37.12 18.35 73.76 37.09 16.69 72.44 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 29.81 8.06 73.13 30.21 10.11 72.95 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 37.29 15.56 67.90 37.37 13.79 70.08 23.82 -21.26 -14.80 24.13 -23.57 -16.35 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 164 GLU~? 5.82 O1 FMT A 175 B 47 ASP A 129 ASP~? 7.83 O1 FMT A 176 B 161 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 53.87 35.49 53.22 55.44 35.72 54.61 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 63.47 43.65 53.95 61.45 43.07 54.06 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 56.38 35.81 59.19 58.25 35.77 57.10 23.82 -21.26 -14.80 24.13 -23.57 -16.35 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 104 ASN~? -3.09 C4 PEG A 177s B 108 HIS A 103 HIS~? 8.30 O2 FMT A 174 B 144 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo 36.64 101.02 13.15 38.55 101.84 12.78 35.06 -12.01 -19.02 34.43 -13.28 -20.72 coo 41.00 107.18 12.86 42.70 107.82 11.96 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 31.60 110.69 6.14 29.69 109.74 5.94 25.17 -6.99 -19.79 25.21 -6.55 -17.70 1grc_c03 source 1grc GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE (E.C: 1 hits 1grc_c03 naa= 3 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 1 3 # 1 160 LYS A 157 LYS~? 15.32 C FMT A 174 210 ARG A 107 ARG~? -5.14 O2 PEG A 177s 225 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 24.74 11.56 73.05 25.29 14.32 71.80 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 27.81 15.44 77.10 25.66 16.50 75.19 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS A 157 LYS~? 15.32 C FMT A 174 210 ARG A 111 ARG~? -4.31 O1 PEG A 177s 225 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 24.74 11.56 73.05 25.29 14.32 71.80 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 27.81 15.44 77.10 25.66 16.50 75.19 32.48 -6.37 -21.24 35.08 -7.16 -19.82 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 3 3 # 3 160 LYS A 157 LYS~? 15.32 C FMT A 174 210 ARG A 132 ARG~? 15.71 O4 PEG A 177 225 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 24.74 11.56 73.05 25.29 14.32 71.80 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 27.81 15.44 77.10 25.66 16.50 75.19 16.63 -21.80 -25.68 14.14 -20.50 -26.99 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 4 3 # 4 160 LYS A 160 LYS~? 7.79 O1 FMT A 175 210 ARG A 107 ARG~? -5.14 O2 PEG A 177s 225 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 24.74 11.56 73.05 25.29 14.32 71.80 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 27.81 15.44 77.10 25.66 16.50 75.19 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 5 3 # 5 160 LYS A 160 LYS~? 7.79 O1 FMT A 175 210 ARG A 111 ARG~? -4.31 O1 PEG A 177s 225 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 24.74 11.56 73.05 25.29 14.32 71.80 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 27.81 15.44 77.10 25.66 16.50 75.19 32.48 -6.37 -21.24 35.08 -7.16 -19.82 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 6 3 # 6 160 LYS A 160 LYS~? 7.79 O1 FMT A 175 210 ARG A 132 ARG~? 15.71 O4 PEG A 177 225 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 24.74 11.56 73.05 25.29 14.32 71.80 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 27.81 15.44 77.10 25.66 16.50 75.19 16.63 -21.80 -25.68 14.14 -20.50 -26.99 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 7 3 # 7 160 LYS A 160 LYS~? 7.79 O1 FMT A 175 210 ARG A 136 ARG~? -19.53 O1 PEG A 177s 225 ARG A 132 ARG~? 15.71 O4 PEG A 177 coo 17.51 28.50 73.42 17.24 23.02 75.86 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 24.74 11.56 73.05 25.29 14.32 71.80 16.63 -21.80 -25.68 14.14 -20.50 -26.99 coo 27.81 15.44 77.10 25.66 16.50 75.19 21.56 -24.77 -26.82 24.40 -25.49 -27.78 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 8 3 # 8 160 LYS A 160 LYS~? 7.79 O1 FMT A 175 210 ARG A 136 ARG~? -19.53 O1 PEG A 177s 225 ARG A 140 ARG~? -21.39 O1 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 24.74 11.56 73.05 25.29 14.32 71.80 16.63 -21.80 -25.68 14.14 -20.50 -26.99 coo 27.81 15.44 77.10 25.66 16.50 75.19 10.76 -17.91 -21.91 12.11 -20.58 -22.47 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 9 3 # 9 160 LYS A 160 LYS~? 7.79 O1 FMT A 175 210 ARG A 140 ARG~? -21.39 O1 PEG A 177s 225 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 17.51 28.50 73.42 17.24 23.02 75.86 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 24.74 11.56 73.05 25.29 14.32 71.80 10.76 -17.91 -21.91 12.11 -20.58 -22.47 coo 27.81 15.44 77.10 25.66 16.50 75.19 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 9 hits 1gsa_c00 naa= 3 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 A 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 329 LYS A 157 LYS~? 15.32 C FMT A 174 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 2.59 0.29 25.55 4.65 0.18 25.07 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 12.42 6.10 23.27 9.95 1.57 20.16 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 A 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 329 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 2.59 0.29 25.55 4.65 0.18 25.07 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 12.42 6.10 23.27 9.95 1.57 20.16 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1gtx_c00 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c00 naa= 3 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 B 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 329 LYS A 157 LYS~? 15.32 C FMT A 174 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 B 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 329 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1gtx_c01 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c01 naa= 3 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 C 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 C 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 C 329 LYS A 157 LYS~? 15.32 C FMT A 174 coo 17.41 60.57 64.39 18.40 58.12 65.34 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 24.10 66.43 63.33 24.18 64.30 63.40 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 27.64 56.61 58.17 22.18 57.92 60.36 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 C 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 C 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 C 329 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 17.41 60.57 64.39 18.40 58.12 65.34 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 24.10 66.43 63.33 24.18 64.30 63.40 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 27.64 56.61 58.17 22.18 57.92 60.36 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1gtx_c02 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c02 naa= 3 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 D 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 D 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 D 329 LYS A 157 LYS~? 15.32 C FMT A 174 coo 35.44 53.35 83.81 35.65 54.53 81.28 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 29.72 46.46 83.60 30.79 47.36 81.99 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 36.89 44.91 74.55 37.33 48.94 79.01 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 D 189 PHE A 123 PHE~? 8.93 O4 PEG A 177 D 298 ASP A 131 ASP~? 16.41 O2 FMT A 176 D 329 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 35.44 53.35 83.81 35.65 54.53 81.28 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 29.72 46.46 83.60 30.79 47.36 81.99 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 36.89 44.91 74.55 37.33 48.94 79.01 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1gtx_c03 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c03 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 146 VAL~? 15.33 O2 FMT A 174 A 200 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 226 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 19.13 38.05 1.41 19.72 38.80 -0.53 13.45 -6.07 -17.93 15.18 -5.66 -19.32 coo 24.51 43.28 11.18 25.17 44.50 9.58 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 34.47 51.09 7.19 28.58 51.18 7.53 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1i29_c03 source 1i29 CSDB : 1 hits 1i29_c03 naa= 3 ULMN 3 1itx_c00 GLYCOSYL HYDROLASE user 1 3 # 1 A 202 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 204 GLU A 167 GLU~? -4.28 O1 FMT A 176s A 279 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 5.85 5.60 30.32 5.00 7.49 29.88 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 7.79 1.83 27.81 9.08 3.25 26.92 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 8.22 7.77 18.64 7.58 8.47 21.28 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1itx_c00 source 1itx GLYCOSYL HYDROLASE : 1 hits 1itx_c00 naa= 3 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 581 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 713 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 23.87 26.44 -10.48 23.95 28.93 -12.26 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 581 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 713 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 23.87 26.44 -10.48 23.95 28.93 -12.26 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 3 3 # 3 A 396 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 581 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 713 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 4 3 # 4 A 396 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 581 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 713 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 20.90 -10.04 -7.22 20.67 -7.48 -5.33 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 5 3 # 5 A 396 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 581 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 713 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 23.87 26.44 -10.48 23.95 28.93 -12.26 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 # 6 A 396 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 581 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 713 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 23.87 26.44 -10.48 23.95 28.93 -12.26 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 32.48 -6.37 -21.24 35.08 -7.16 -19.82 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 7 3 # 7 A 396 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 581 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 713 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 8 3 # 8 A 396 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 581 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 713 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 23.87 26.44 -10.48 23.95 28.93 -12.26 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 9 3 # 9 A 396 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 581 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 713 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 20.90 -10.04 -7.22 20.67 -7.48 -5.33 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 10 3 # 10 A 396 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 581 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 713 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 23.87 26.44 -10.48 23.95 28.93 -12.26 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1jqn_c01 source 1jqn PHOSPHOENOLPYRUVATE CARBOXYLASE : 10 hits 1jqn_c01 naa= 3 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 # 1 A 55 ASP A 116 ASP~? 12.69 O1 PEG A 177 A 58 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 424 GLU A 121 GLU~? 15.09 C1 PEG A 177 coo 58.42 47.76 20.67 58.01 49.10 19.12 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 58.59 41.80 18.81 58.94 43.89 18.94 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 52.85 46.34 13.34 54.09 44.97 14.42 23.47 -20.47 -31.08 23.01 -22.26 -29.87 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 2 3 # 2 A 55 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 58 ASP A 116 ASP~? 12.69 O1 PEG A 177 A 424 GLU A 121 GLU~? 15.09 C1 PEG A 177 coo 58.42 47.76 20.67 58.01 49.10 19.12 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 58.59 41.80 18.81 58.94 43.89 18.94 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 52.85 46.34 13.34 54.09 44.97 14.42 23.47 -20.47 -31.08 23.01 -22.26 -29.87 1js4_c00 source 1js4 ENDO-EXOCELLULASE E4 : 2 hits 1js4_c00 naa= 3 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 # 1 B 55 ASP A 116 ASP~? 12.69 O1 PEG A 177 B 58 ASP A 119 ASP~? 7.68 O1 PEG A 177 B 424 GLU A 121 GLU~? 15.09 C1 PEG A 177 coo 112.10 61.46 19.99 111.82 60.65 18.07 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 117.85 63.62 21.08 115.96 63.25 20.18 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 118.47 57.23 15.57 119.32 58.77 16.73 23.47 -20.47 -31.08 23.01 -22.26 -29.87 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 # 2 B 55 ASP A 119 ASP~? 7.68 O1 PEG A 177 B 58 ASP A 116 ASP~? 12.69 O1 PEG A 177 B 424 GLU A 121 GLU~? 15.09 C1 PEG A 177 coo 112.10 61.46 19.99 111.82 60.65 18.07 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 117.85 63.62 21.08 115.96 63.25 20.18 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 118.47 57.23 15.57 119.32 58.77 16.73 23.47 -20.47 -31.08 23.01 -22.26 -29.87 1js4_c01 source 1js4 ENDO-EXOCELLULASE E4 : 2 hits 1js4_c01 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 A 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 A 258 ARG A 65 ARG~? 29.62 O1 FMT A 174 coo 42.33 1.56 26.99 42.38 2.91 28.66 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 38.45 -0.44 19.89 37.36 0.90 25.90 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 47.05 3.71 11.47 47.46 0.69 10.93 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 A 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 A 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 A 258 ARG A 67 ARG~? 43.16 O1 FMT A 174 coo 42.33 1.56 26.99 42.38 2.91 28.66 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 38.45 -0.44 19.89 37.36 0.90 25.90 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 57.57 5.82 16.12 60.39 6.14 14.88 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 B 258 ARG A 65 ARG~? 29.62 O1 FMT A 174 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 2.64 1.83 34.81 1.56 1.13 32.02 47.05 3.71 11.47 47.46 0.69 10.93 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 B 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 B 258 ARG A 67 ARG~? 43.16 O1 FMT A 174 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 2.64 1.83 34.81 1.56 1.13 32.02 57.57 5.82 16.12 60.39 6.14 14.88 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 C 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 C 258 ARG A 65 ARG~? 29.62 O1 FMT A 174 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 47.05 3.71 11.47 47.46 0.69 10.93 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 C 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 C 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 C 258 ARG A 67 ARG~? 43.16 O1 FMT A 174 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 57.57 5.82 16.12 60.39 6.14 14.88 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 D 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 D 258 ARG A 65 ARG~? 29.62 O1 FMT A 174 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 47.05 3.71 11.47 47.46 0.69 10.93 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 D 2 GLU A 55 GLU~? 39.06 O1 FMT A 174 D 56 LYS A 51 LYS~? 41.76 O1 FMT A 175 D 258 ARG A 67 ARG~? 43.16 O1 FMT A 174 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 57.57 5.82 16.12 60.39 6.14 14.88 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c03 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 163 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 222 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 51.27 81.34 48.31 51.67 80.79 50.28 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 48.06 78.22 50.94 48.51 78.27 53.98 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 54.85 84.16 52.60 54.26 81.23 53.34 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 163 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 222 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 51.27 81.34 48.31 51.67 80.79 50.28 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 48.06 78.22 50.94 48.51 78.27 53.98 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 54.85 84.16 52.60 54.26 81.23 53.34 32.48 -6.37 -21.24 35.08 -7.16 -19.82 1kim_c00 source 1kim THYMIDINE KINASE : 2 hits 1kim_c00 naa= 3 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 1 3 # 1 A 290 ARG A 67 ARG~? 43.16 O1 FMT A 174 A 351 HIS A 68 HIS~? 36.06 O1 FMT A 174 A 386 LEU A 70 LEU~? 39.01 O1 FMT A 174 coo 57.36 53.34 128.83 58.45 50.56 128.34 57.57 5.82 16.12 60.39 6.14 14.88 coo 60.60 50.64 133.59 60.63 48.82 132.56 53.15 0.53 14.80 53.37 -1.51 15.17 coo 63.28 54.23 126.45 63.53 52.07 126.70 57.94 5.95 10.73 57.64 7.81 9.79 1knp_c00 source 1knp L-ASPARTATE OXIDASE : 1 hits 1knp_c00 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 38 ASP~? 19.22 O1 FMT A 175 262 LYS A 42 LYS.? 22.49 C FMT A 175 336 ARG A 31 ARG~? 22.01 O1 FMT A 174 coo 61.88 50.78 12.96 63.84 50.60 13.71 46.18 -16.53 5.44 45.49 -18.23 4.73 coo 63.59 44.40 18.32 63.20 49.74 17.95 54.15 -17.47 3.60 51.97 -21.51 1.29 coo 72.60 57.42 15.86 71.61 56.68 18.70 48.96 -3.53 -0.04 48.31 -5.49 -2.36 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP A 78 ASP~? 43.27 O2 FMT A 175 262 LYS A 74 LYS~? 39.82 O1 FMT A 174 336 ARG A 50 ARG~? 30.44 C FMT A 175 coo 61.88 50.78 12.96 63.84 50.60 13.71 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 63.59 44.40 18.32 63.20 49.74 17.95 62.62 1.22 9.29 60.96 4.34 8.46 coo 72.60 57.42 15.86 71.61 56.68 18.70 56.17 -13.83 11.47 55.95 -14.59 8.45 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 3 3 # 3 255 ASP A 166 ASP~? 5.39 O2 FMT A 176 262 LYS A 160 LYS~? 7.79 O1 FMT A 175 336 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 61.88 50.78 12.96 63.84 50.60 13.71 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 63.59 44.40 18.32 63.20 49.74 17.95 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 72.60 57.42 15.86 71.61 56.68 18.70 32.48 -6.37 -21.24 35.08 -7.16 -19.82 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 4 3 # 4 255 ASP A 166 ASP~? 5.39 O2 FMT A 176 262 LYS A 160 LYS~? 7.79 O1 FMT A 175 336 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 61.88 50.78 12.96 63.84 50.60 13.71 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 63.59 44.40 18.32 63.20 49.74 17.95 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 72.60 57.42 15.86 71.61 56.68 18.70 27.44 -10.86 -26.00 28.74 -11.94 -28.55 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 4 hits 1lam_c00 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 114 ALA~? 10.03 O1 PEG A 177 A 317 GLY A 115 GLY~? 10.22 O1 PEG A 177 A 318 ASP A 116 ASP~? 12.69 O1 PEG A 177 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 20.00 -7.73 -24.16 20.99 -6.50 -24.22 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 20.38 -10.05 -27.18 19.80 -10.39 -26.64 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 18.27 -12.70 -29.95 19.69 -12.41 -31.48 ULMN 3 1lij_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA A 114 ALA~? 10.03 O1 PEG A 177 A 317 GLY A 115 GLY~? 10.22 O1 PEG A 177 A 318 ASP A 119 ASP~? 7.68 O1 PEG A 177 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 20.00 -7.73 -24.16 20.99 -6.50 -24.22 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 20.38 -10.05 -27.18 19.80 -10.39 -26.64 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 23.95 -13.44 -27.62 23.92 -11.77 -28.82 1lij_c01 source 1lij ADENOSINE KINASE : 2 hits 1lij_c01 naa= 3 ULMN 3 1m53_c03 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 295 GLU A 167 GLU~? -4.28 O1 FMT A 176s A 369 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 16.11 33.72 80.99 14.10 33.54 81.63 35.33 -23.68 -13.20 34.70 -25.59 -12.86 coo 12.19 31.08 87.29 11.13 32.66 86.38 29.91 -28.16 -19.91 31.33 -29.73 -20.56 1m53_c03 source 1m53 ISOMALTULOSE SYNTHASE : 1 hits 1m53_c03 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 78 ASP~? 43.27 O2 FMT A 175 A 265 GLU A 30 GLU~? 28.79 O1 FMT A 174 A 369 ASP A 80 ASP~? 35.02 C FMT A 176 coo 11.74 38.14 80.19 10.63 36.40 80.65 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 17.36 23.57 72.04 18.68 21.92 71.98 50.95 1.74 4.18 49.94 3.63 4.45 coo 12.19 31.08 87.29 11.13 32.66 86.38 64.20 -10.93 1.69 64.86 -11.65 -0.10 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 80 ASP~? 35.02 C FMT A 176 A 265 GLU A 30 GLU~? 28.79 O1 FMT A 174 A 369 ASP A 78 ASP~? 43.27 O2 FMT A 175 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.20 -10.93 1.69 64.86 -11.65 -0.10 coo 17.36 23.57 72.04 18.68 21.92 71.98 50.95 1.74 4.18 49.94 3.63 4.45 coo 12.19 31.08 87.29 11.13 32.66 86.38 65.63 -6.29 9.14 66.97 -5.21 10.41 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c05 naa= 3 ULMN 3 1mdr_c01 MANDELATE RACEMASE (E.C.5.1.2.2) user 1 3 # 1 164 LYS A 160 LYS~? 7.79 O1 FMT A 175 166 LYS A 157 LYS~? 15.32 C FMT A 174 324 SER A 94 SER~? 15.65 O2 FMT A 175 coo 25.93 8.11 25.51 26.40 7.80 19.66 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 27.27 1.43 25.09 29.18 5.25 22.89 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 46.32 14.55 19.93 45.95 12.72 21.27 45.82 -13.49 -9.13 45.45 -14.29 -6.96 1mdr_c01 source 1mdr MANDELATE RACEMASE (E.C.5.1.2.2) : 1 hits 1mdr_c01 naa= 3 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 3 # 1 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 35 SER A 94 SER~? 15.65 O2 FMT A 175 215 ASP A 89 ASP~? 23.36 C FMT A 176 coo 20.97 14.47 32.28 19.66 15.96 31.62 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 16.04 14.72 33.82 17.27 13.71 31.95 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 20.65 22.00 33.80 20.06 20.56 32.39 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1mpp_c04 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 1 hits 1mpp_c04 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 101 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 132 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo 11.61 22.83 17.30 14.06 21.71 15.78 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 11.37 24.94 11.48 12.48 24.45 13.28 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 16.14 18.17 13.37 15.92 19.81 14.71 25.17 -6.99 -19.79 25.21 -6.55 -17.70 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 111 ARG~? -4.31 O1 PEG A 177s B 101 ASP A 119 ASP~? 7.68 O1 PEG A 177 B 132 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo 11.61 3.43 18.38 9.11 4.29 16.86 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 11.74 0.51 12.98 10.75 1.32 14.67 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 6.93 7.52 14.08 7.18 6.08 15.65 25.17 -6.99 -19.79 25.21 -6.55 -17.70 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 101 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 132 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo 11.50 22.77 17.24 14.00 21.62 15.86 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 11.19 25.00 11.76 12.16 24.45 13.59 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 16.04 18.11 13.43 15.88 19.70 14.83 25.17 -6.99 -19.79 25.21 -6.55 -17.70 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 111 ARG~? -4.31 O1 PEG A 177s B 101 ASP A 119 ASP~? 7.68 O1 PEG A 177 B 132 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo 11.48 3.09 18.25 9.01 4.07 16.77 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 11.83 0.33 13.01 10.88 1.04 14.81 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 6.85 7.33 14.07 7.10 5.88 15.60 25.17 -6.99 -19.79 25.21 -6.55 -17.70 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nww_c03 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 137 SER~? 20.06 O2 FMT A 175 A 154 ASP A 116 ASP~? 12.69 O1 PEG A 177 A 261 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 16.10 74.10 3.11 17.18 73.52 5.20 14.70 -20.28 -19.59 13.65 -21.31 -17.79 coo 16.07 84.71 8.14 15.20 82.81 8.14 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 10.59 77.85 4.81 13.09 76.36 5.76 16.63 -21.80 -25.68 14.14 -20.50 -26.99 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 2 3 # 2 A 62 SER A 137 SER~? 20.06 O2 FMT A 175 A 154 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 261 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 16.10 74.10 3.11 17.18 73.52 5.20 14.70 -20.28 -19.59 13.65 -21.31 -17.79 coo 16.07 84.71 8.14 15.20 82.81 8.14 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 10.59 77.85 4.81 13.09 76.36 5.76 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 2 hits 1o98_c00 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -3.50 124.89 25.05 -2.25 124.77 23.26 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 1.87 119.38 16.45 1.41 122.11 16.84 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -2.59 124.07 12.67 -0.91 126.17 18.42 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 B 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -7.43 109.06 51.23 -5.84 110.54 50.86 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 0.22 114.56 44.62 -0.76 115.18 47.18 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -4.18 120.17 46.85 -4.02 115.31 51.00 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 C 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 C 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -13.49 79.65 43.90 -12.13 80.29 45.45 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -5.65 86.78 48.49 -7.16 84.72 49.65 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -11.22 87.18 53.49 -10.94 81.64 50.31 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 D 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 D 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -13.44 77.36 13.12 -12.53 75.97 14.48 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -7.85 74.44 22.75 -9.22 72.86 20.89 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -14.24 70.61 23.48 -12.55 71.73 17.42 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 E 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 E 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -7.12 105.25 1.43 -6.30 103.34 0.77 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -3.11 94.55 3.01 -3.83 95.92 0.66 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 F 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 F 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -44.75 128.15 10.28 -45.68 129.67 11.55 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -50.43 131.90 19.60 -49.04 133.31 17.60 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -44.10 135.86 19.99 -45.67 134.21 14.07 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 G 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 G 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -44.97 128.78 41.20 -46.32 128.26 42.83 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -52.83 122.13 46.42 -51.31 124.30 47.39 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -47.30 122.24 51.49 -47.46 127.44 47.81 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 H 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 H 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -51.11 100.30 51.41 -52.67 98.82 51.12 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -58.70 94.17 45.32 -57.76 93.82 47.92 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -54.32 88.79 48.13 -54.61 94.04 51.74 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 I 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 I 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -54.65 81.97 26.87 -55.88 81.89 25.07 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -59.92 86.62 17.74 -59.42 83.94 18.40 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -55.38 81.61 14.50 -57.11 80.05 20.41 20.67 -15.87 -11.19 14.43 -16.61 -10.33 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 166 ASP~? 5.39 O2 FMT A 176 J 146 TYR A 161 TYR~? 10.37 O2 FMT A 175 J 177 LYS A 157 LYS~? 15.32 C FMT A 174 coo -50.64 99.08 1.52 -51.52 100.83 0.67 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 20.67 -15.87 -11.19 14.43 -16.61 -10.33 1ok4_c09 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 1 hits 1ok4_c09 naa= 3 ULMN 3 1onr_c00 TRANSALDOLASE B user 1 3 # 1 A 17 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 96 GLU A 126 GLU~? 5.29 O4 PEG A 177 A 132 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 31.23 12.29 16.44 30.82 11.56 18.39 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 26.82 3.20 24.36 27.99 4.86 24.98 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 29.99 0.62 22.18 30.38 6.69 20.81 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1onr_c00 TRANSALDOLASE B user 2 3 # 2 A 17 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 96 GLU A 121 GLU~? 15.09 C1 PEG A 177 A 132 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 31.23 12.29 16.44 30.82 11.56 18.39 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 26.82 3.20 24.36 27.99 4.86 24.98 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 29.99 0.62 22.18 30.38 6.69 20.81 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1onr_c00 TRANSALDOLASE B user 3 3 # 3 A 17 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 96 GLU A 164 GLU~? 5.82 O1 FMT A 175 A 132 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 31.23 12.29 16.44 30.82 11.56 18.39 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 26.82 3.20 24.36 27.99 4.86 24.98 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 29.99 0.62 22.18 30.38 6.69 20.81 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1onr_c00 source 1onr TRANSALDOLASE B : 3 hits 1onr_c00 naa= 3 ULMN 3 1onr_c01 TRANSALDOLASE B user 1 3 # 1 B 17 ASP A 129 ASP~? 7.83 O1 FMT A 176 B 96 GLU A 126 GLU~? 5.29 O4 PEG A 177 B 132 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 31.16 57.31 -0.94 30.73 56.64 1.01 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 26.69 48.45 7.18 27.85 50.13 7.74 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 29.82 45.80 5.07 30.26 51.81 3.56 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1onr_c01 TRANSALDOLASE B user 2 3 # 2 B 17 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 96 GLU A 121 GLU~? 15.09 C1 PEG A 177 B 132 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 31.16 57.31 -0.94 30.73 56.64 1.01 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 26.69 48.45 7.18 27.85 50.13 7.74 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 29.82 45.80 5.07 30.26 51.81 3.56 28.30 -17.74 -28.93 30.33 -16.15 -33.80 ULMN 3 1onr_c01 TRANSALDOLASE B user 3 3 # 3 B 17 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 96 GLU A 164 GLU~? 5.82 O1 FMT A 175 B 132 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 31.16 57.31 -0.94 30.73 56.64 1.01 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 26.69 48.45 7.18 27.85 50.13 7.74 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 29.82 45.80 5.07 30.26 51.81 3.56 25.45 -16.84 -10.59 23.78 -19.75 -6.08 1onr_c01 source 1onr TRANSALDOLASE B : 3 hits 1onr_c01 naa= 3 ULMN 3 1oyg_c00 LEVANSUCRASE user 1 3 # 1 A 86 ASP A 116 ASP~? 12.69 O1 PEG A 177 A 247 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 342 GLU A 121 GLU~? 15.09 C1 PEG A 177 coo 44.36 35.68 9.71 43.29 36.20 11.51 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 41.40 28.81 12.91 40.82 30.90 12.97 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 40.37 33.11 18.06 39.99 34.93 17.06 23.47 -20.47 -31.08 23.01 -22.26 -29.87 ULMN 3 1oyg_c00 LEVANSUCRASE user 2 3 # 2 A 86 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 247 ASP A 117 ASP~? 15.82 O1 PEG A 177 A 342 GLU A 121 GLU~? 15.09 C1 PEG A 177 coo 44.36 35.68 9.71 43.29 36.20 11.51 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 41.40 28.81 12.91 40.82 30.90 12.97 18.71 -17.67 -30.43 18.68 -19.55 -29.48 coo 40.37 33.11 18.06 39.99 34.93 17.06 23.47 -20.47 -31.08 23.01 -22.26 -29.87 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 24 ALA~? 34.25 O1 FMT A 174 A 126 LEU A 28 LEU~? 31.53 O1 FMT A 174 A 158 GLU A 30 GLU~? 28.79 O1 FMT A 174 coo -2.29 37.66 144.73 -1.46 37.12 145.87 58.09 3.11 -1.09 59.14 2.87 -2.21 coo -4.62 32.83 147.14 -5.50 32.85 149.12 56.67 -2.02 1.26 57.08 -4.17 1.18 coo -0.83 29.57 149.77 -0.39 31.47 148.95 50.95 1.74 4.18 49.94 3.63 4.45 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 130 ALA~? 10.57 O2 FMT A 176 A 126 LEU A 165 LEU~? -7.26 O2 FMT A 176s A 158 GLU A 164 GLU~? 5.82 O1 FMT A 175 coo -2.29 37.66 144.73 -1.46 37.12 145.87 26.26 -25.01 -20.40 26.12 -23.73 -21.18 coo -4.62 32.83 147.14 -5.50 32.85 149.12 29.59 -22.25 -16.75 27.66 -23.11 -17.39 coo -0.83 29.57 149.77 -0.39 31.47 148.95 27.84 -22.33 -10.08 25.81 -22.69 -9.75 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 24 ALA~? 34.25 O1 FMT A 174 B 126 LEU A 28 LEU~? 31.53 O1 FMT A 174 B 158 GLU A 30 GLU~? 28.79 O1 FMT A 174 coo -39.79 4.61 147.27 -39.61 5.56 148.47 58.09 3.11 -1.09 59.14 2.87 -2.21 coo -34.22 5.06 149.25 -33.65 4.24 151.15 56.67 -2.02 1.26 57.08 -4.17 1.18 coo -33.03 9.93 151.71 -34.98 9.38 151.11 50.95 1.74 4.18 49.94 3.63 4.45 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 130 ALA~? 10.57 O2 FMT A 176 B 126 LEU A 165 LEU~? -7.26 O2 FMT A 176s B 158 GLU A 164 GLU~? 5.82 O1 FMT A 175 coo -39.79 4.61 147.27 -39.61 5.56 148.47 26.26 -25.01 -20.40 26.12 -23.73 -21.18 coo -34.22 5.06 149.25 -33.65 4.24 151.15 29.59 -22.25 -16.75 27.66 -23.11 -17.39 coo -33.03 9.93 151.71 -34.98 9.38 151.11 27.84 -22.33 -10.08 25.81 -22.69 -9.75 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA A 130 ALA~? 10.57 O2 FMT A 176 B 126 LEU A 165 LEU~? -7.26 O2 FMT A 176s B 158 GLU A 167 GLU~? -4.28 O1 FMT A 176s coo -39.79 4.61 147.27 -39.61 5.56 148.47 26.26 -25.01 -20.40 26.12 -23.73 -21.18 coo -34.22 5.06 149.25 -33.65 4.24 151.15 29.59 -22.25 -16.75 27.66 -23.11 -17.39 coo -33.03 9.93 151.71 -34.98 9.38 151.11 35.33 -23.68 -13.20 34.70 -25.59 -12.86 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 24 ALA~? 34.25 O1 FMT A 174 C 126 LEU A 28 LEU~? 31.53 O1 FMT A 174 C 158 GLU A 30 GLU~? 28.79 O1 FMT A 174 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 58.09 3.11 -1.09 59.14 2.87 -2.21 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 56.67 -2.02 1.26 57.08 -4.17 1.18 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 50.95 1.74 4.18 49.94 3.63 4.45 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 130 ALA~? 10.57 O2 FMT A 176 C 126 LEU A 165 LEU~? -7.26 O2 FMT A 176s C 158 GLU A 164 GLU~? 5.82 O1 FMT A 175 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 26.26 -25.01 -20.40 26.12 -23.73 -21.18 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 29.59 -22.25 -16.75 27.66 -23.11 -17.39 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 27.84 -22.33 -10.08 25.81 -22.69 -9.75 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c02 naa= 3 ULMN 3 1pow_c02 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 1 3 # 1 A 264 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 479 PHE A 159 PHE~? -4.02 C FMT A 174s A 483 GLU A 106 GLU~? -4.32 O2 FMT A 174s coo 17.33 52.29 2.24 18.71 54.03 0.18 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 20.06 57.44 1.28 18.39 56.19 3.12 26.92 -12.38 -12.27 29.60 -11.66 -11.97 coo 17.33 54.96 -3.04 16.34 56.76 -2.51 30.43 -7.44 -15.33 30.95 -6.29 -13.59 1pow_c02 source 1pow PYRUVATE OXIDASE (E.C.1.2.3.3) (WILD TYPE) : 1 hits 1pow_c02 naa= 3 ULMN 3 1pow_c03 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 1 3 # 1 B 264 ARG A 109 ARG~? -3.22 O2 FMT A 174s B 479 PHE A 159 PHE~? -4.02 C FMT A 174s B 483 GLU A 106 GLU~? -4.32 O2 FMT A 174s coo -26.72 93.28 20.13 -28.02 93.55 17.39 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo -29.34 90.48 15.69 -27.62 89.95 17.80 26.92 -12.38 -12.27 29.60 -11.66 -11.97 coo -26.63 95.49 14.65 -25.77 93.77 13.77 30.43 -7.44 -15.33 30.95 -6.29 -13.59 1pow_c03 source 1pow PYRUVATE OXIDASE (E.C.1.2.3.3) (WILD TYPE) : 1 hits 1pow_c03 naa= 3 ULMN 3 1pyl_c00 RIBONUCLEASE user 1 3 # 1 A 56 GLU A 30 GLU~? 28.79 O1 FMT A 174 A 67 ARG A 65 ARG~? 29.62 O1 FMT A 174 A 86 HIS A 68 HIS~? 36.06 O1 FMT A 174 coo 18.15 3.28 18.56 20.10 2.92 19.20 50.95 1.74 4.18 49.94 3.63 4.45 coo 21.52 6.83 26.64 21.22 5.53 23.85 47.05 3.71 11.47 47.46 0.69 10.93 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 53.15 0.53 14.80 53.37 -1.51 15.17 1pyl_c00 source 1pyl RIBONUCLEASE : 1 hits 1pyl_c00 naa= 3 ULMN 3 1pyl_c01 RIBONUCLEASE user 1 3 # 1 B 56 GLU A 30 GLU~? 28.79 O1 FMT A 174 B 67 ARG A 65 ARG~? 29.62 O1 FMT A 174 B 86 HIS A 68 HIS~? 36.06 O1 FMT A 174 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 50.95 1.74 4.18 49.94 3.63 4.45 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 47.05 3.71 11.47 47.46 0.69 10.93 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 53.15 0.53 14.80 53.37 -1.51 15.17 1pyl_c01 source 1pyl RIBONUCLEASE : 1 hits 1pyl_c01 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 112 LEU~? 8.73 O1 PEG A 177 A 58 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 120 LYS A 122 LYS~? 10.14 O4 PEG A 177 coo 34.02 69.29 75.26 34.82 67.82 76.74 22.91 -13.65 -22.27 24.26 -15.38 -22.53 coo 34.46 72.45 78.57 32.82 72.75 77.28 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 28.96 77.64 81.19 29.05 74.53 77.51 28.30 -17.74 -28.93 30.33 -16.15 -33.80 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 1 hits 1pym_c00 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 68 ALA A 24 ALA~? 34.25 O1 FMT A 174 A 72 LEU A 22 LEU~? 38.89 O1 FMT A 174 coo 46.76 7.59 18.65 45.27 6.01 18.52 54.21 2.61 0.04 53.68 4.66 -0.22 coo 48.88 4.35 16.59 48.73 5.09 15.20 58.09 3.11 -1.09 59.14 2.87 -2.21 coo 53.89 6.25 15.09 52.88 7.92 14.14 62.27 6.86 -0.08 62.45 7.08 -2.27 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 27 ASP~? 30.54 O1 FMT A 174 A 68 ALA A 24 ALA~? 34.25 O1 FMT A 174 A 72 LEU A 25 LEU~? 37.10 O1 FMT A 174 coo 46.76 7.59 18.65 45.27 6.01 18.52 54.21 2.61 0.04 53.68 4.66 -0.22 coo 48.88 4.35 16.59 48.73 5.09 15.20 58.09 3.11 -1.09 59.14 2.87 -2.21 coo 53.89 6.25 15.09 52.88 7.92 14.14 60.61 1.05 2.71 62.58 0.13 2.49 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 # 3 A 67 ASP A 38 ASP~? 19.22 O1 FMT A 175 A 68 ALA A 37 ALA~? 25.18 O1 FMT A 175 A 72 LEU A 35 LEU.? 24.21 O2 FMT A 175 coo 46.76 7.59 18.65 45.27 6.01 18.52 46.18 -16.53 5.44 45.49 -18.23 4.73 coo 48.88 4.35 16.59 48.73 5.09 15.20 47.89 -13.84 8.41 47.54 -14.19 9.91 coo 53.89 6.25 15.09 52.88 7.92 14.14 48.36 -9.34 4.07 49.21 -8.33 2.26 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 # 4 A 67 ASP A 38 ASP~? 19.22 O1 FMT A 175 A 68 ALA A 37 ALA~? 25.18 O1 FMT A 175 A 72 LEU A 40 LEU~? 27.04 O2 FMT A 175 coo 46.76 7.59 18.65 45.27 6.01 18.52 46.18 -16.53 5.44 45.49 -18.23 4.73 coo 48.88 4.35 16.59 48.73 5.09 15.20 47.89 -13.84 8.41 47.54 -14.19 9.91 coo 53.89 6.25 15.09 52.88 7.92 14.14 51.49 -12.49 7.11 50.89 -10.44 7.46 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 5 3 # 5 A 67 ASP A 47 ASP~? 38.21 O1 FMT A 175 A 68 ALA A 48 ALA~? 40.58 O2 FMT A 175 A 72 LEU A 49 LEU~? 35.18 O2 FMT A 175 coo 46.76 7.59 18.65 45.27 6.01 18.52 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 48.88 4.35 16.59 48.73 5.09 15.20 60.35 -8.17 14.75 61.63 -7.26 14.84 coo 53.89 6.25 15.09 52.88 7.92 14.14 58.47 -7.64 10.23 57.81 -6.14 8.77 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 6 3 # 6 A 67 ASP A 80 ASP~? 35.02 C FMT A 176 A 68 ALA A 83 ALA~? 31.68 C FMT A 176 A 72 LEU A 85 LEU~? 31.23 C FMT A 176 coo 46.76 7.59 18.65 45.27 6.01 18.52 64.20 -10.93 1.69 64.86 -11.65 -0.10 coo 48.88 4.35 16.59 48.73 5.09 15.20 61.01 -11.63 -2.07 61.56 -12.45 -0.97 coo 53.89 6.25 15.09 52.88 7.92 14.14 58.44 -6.72 -4.22 58.44 -4.58 -3.83 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 7 3 # 7 A 67 ASP A 80 ASP~? 35.02 C FMT A 176 A 68 ALA A 83 ALA~? 31.68 C FMT A 176 A 72 LEU A 87 LEU~? 25.88 C FMT A 176 coo 46.76 7.59 18.65 45.27 6.01 18.52 64.20 -10.93 1.69 64.86 -11.65 -0.10 coo 48.88 4.35 16.59 48.73 5.09 15.20 61.01 -11.63 -2.07 61.56 -12.45 -0.97 coo 53.89 6.25 15.09 52.88 7.92 14.14 55.20 -13.20 -2.12 56.39 -15.01 -2.77 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 8 3 # 8 A 67 ASP A 116 ASP~? 12.69 O1 PEG A 177 A 68 ALA A 118 ALA~? 11.64 O1 PEG A 177 A 72 LEU A 120 LEU~? 12.76 O1 PEG A 177 coo 46.76 7.59 18.65 45.27 6.01 18.52 18.27 -12.70 -29.95 19.69 -12.41 -31.48 coo 48.88 4.35 16.59 48.73 5.09 15.20 22.80 -15.75 -31.66 22.91 -14.62 -32.69 coo 53.89 6.25 15.09 52.88 7.92 14.14 21.87 -18.37 -26.54 21.66 -20.03 -25.08 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 9 3 # 9 A 67 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 68 ALA A 130 ALA~? 10.57 O2 FMT A 176 A 72 LEU A 165 LEU~? -7.26 O2 FMT A 176s coo 46.76 7.59 18.65 45.27 6.01 18.52 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 48.88 4.35 16.59 48.73 5.09 15.20 26.26 -25.01 -20.40 26.12 -23.73 -21.18 coo 53.89 6.25 15.09 52.88 7.92 14.14 29.59 -22.25 -16.75 27.66 -23.11 -17.39 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 10 3 # 10 A 67 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 68 ALA A 130 ALA~? 10.57 O2 FMT A 176 A 72 LEU A 135 LEU~? 13.85 C1 PEG A 177 coo 46.76 7.59 18.65 45.27 6.01 18.52 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 48.88 4.35 16.59 48.73 5.09 15.20 26.26 -25.01 -20.40 26.12 -23.73 -21.18 coo 53.89 6.25 15.09 52.88 7.92 14.14 21.42 -20.74 -20.35 23.11 -19.49 -19.68 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 11 3 # 11 A 67 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 68 ALA A 130 ALA~? 10.57 O2 FMT A 176 A 72 LEU A 165 LEU~? -7.26 O2 FMT A 176s coo 46.76 7.59 18.65 45.27 6.01 18.52 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 48.88 4.35 16.59 48.73 5.09 15.20 26.26 -25.01 -20.40 26.12 -23.73 -21.18 coo 53.89 6.25 15.09 52.88 7.92 14.14 29.59 -22.25 -16.75 27.66 -23.11 -17.39 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 11 hits 1q6l_c05 naa= 3 ULMN 3 1qaz_c00 ALGINATE LYASE A1-III user 1 3 # 1 A 191 ASN A 99 ASN~? 12.05 O2 FMT A 174 A 239 ARG A 101 ARG~? 6.72 O2 FMT A 176 A 246 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 2.50 7.27 18.06 0.76 7.28 16.81 39.44 -8.04 -11.63 39.55 -7.84 -9.53 coo -1.16 0.95 13.41 -2.50 3.71 13.61 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 1.59 5.18 12.30 -0.74 6.52 11.61 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1qaz_c00 source 1qaz ALGINATE LYASE A1-III : 1 hits 1qaz_c00 naa= 3 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 581 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 713 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 23.94 27.00 -9.66 23.90 28.89 -12.21 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 581 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 713 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 3 3 # 3 A 396 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 581 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 713 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 20.90 -10.04 -7.22 20.67 -7.48 -5.33 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 4 3 # 4 A 396 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 581 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 713 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 23.94 27.00 -9.66 23.90 28.89 -12.21 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 5 3 # 5 A 396 ARG A 156 ARG~? 7.82 O1 FMT A 174 A 581 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 713 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 20.90 -10.04 -7.22 20.67 -7.48 -5.33 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 # 6 A 396 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 581 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 713 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 20.90 -10.04 -7.22 20.67 -7.48 -5.33 1qb4_c01 source 1qb4 PHOSPHOENOLPYRUVATE CARBOXYLASE : 6 hits 1qb4_c01 naa= 3 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 A 86 GLU A 55 GLU~? 39.06 O1 FMT A 174 A 143 HIS A 59 HIS~? 37.22 O1 FMT A 174 A 170 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo -2.40 27.37 52.92 -1.22 29.09 52.71 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 1.36 26.79 49.43 3.17 26.89 50.50 50.17 1.75 17.58 51.60 1.04 18.95 coo 7.24 31.80 48.14 6.27 25.92 49.70 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 2 3 # 2 A 86 GLU A 55 GLU~? 39.06 O1 FMT A 174 A 143 HIS A 68 HIS~? 36.06 O1 FMT A 174 A 170 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo -2.40 27.37 52.92 -1.22 29.09 52.71 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 1.36 26.79 49.43 3.17 26.89 50.50 53.15 0.53 14.80 53.37 -1.51 15.17 coo 7.24 31.80 48.14 6.27 25.92 49.70 52.34 7.32 12.03 54.08 9.90 7.62 1qfe_c00 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 2 hits 1qfe_c00 naa= 3 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 B 86 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 143 HIS A 59 HIS~? 37.22 O1 FMT A 174 B 170 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 13.90 37.16 5.96 12.00 36.26 6.12 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 13.52 33.69 9.79 13.20 31.83 8.88 50.17 1.75 17.58 51.60 1.04 18.95 coo 7.52 28.83 11.02 13.59 28.74 9.95 52.34 7.32 12.03 54.08 9.90 7.62 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 2 3 # 2 B 86 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 143 HIS A 68 HIS~? 36.06 O1 FMT A 174 B 170 LYS A 66 LYS~? 36.30 O1 FMT A 174 coo 13.90 37.16 5.96 12.00 36.26 6.12 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 13.52 33.69 9.79 13.20 31.83 8.88 53.15 0.53 14.80 53.37 -1.51 15.17 coo 7.52 28.83 11.02 13.59 28.74 9.95 52.34 7.32 12.03 54.08 9.90 7.62 1qfe_c01 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 2 hits 1qfe_c01 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 C 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 C 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 39.01 29.77 22.02 37.48 31.30 19.84 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 39.51 34.34 13.63 37.63 32.61 14.79 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 45.78 31.11 9.51 44.25 30.06 10.53 29.91 -28.16 -19.91 31.33 -29.73 -20.56 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s C 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 C 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 39.01 29.77 22.02 37.48 31.30 19.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 39.51 34.34 13.63 37.63 32.61 14.79 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 45.78 31.11 9.51 44.25 30.06 10.53 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 D 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 D 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 29.91 -28.16 -19.91 31.33 -29.73 -20.56 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s D 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 D 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 A 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 C 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 55.48 26.51 40.65 55.39 23.99 39.43 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 48.87 29.19 44.63 49.10 27.34 43.63 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 52.39 23.42 32.10 54.51 23.27 34.29 39.00 -16.21 -14.42 38.67 -18.83 -12.88 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 C 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 55.48 26.51 40.65 55.39 23.99 39.43 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 48.87 29.19 44.63 49.10 27.34 43.63 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 52.39 23.42 32.10 54.51 23.27 34.29 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 B 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 D 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 39.00 -16.21 -14.42 38.67 -18.83 -12.88 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 D 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 32.99 -16.32 11.66 35.01 -14.70 12.72 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 G 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 G 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 29.91 -28.16 -19.91 31.33 -29.73 -20.56 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s G 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 G 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 H 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 H 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 29.91 -28.16 -19.91 31.33 -29.73 -20.56 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s H 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 H 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 E 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 G 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 39.00 -16.21 -14.42 38.67 -18.83 -12.88 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 E 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 G 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 127 TYR~? 5.76 O2 FMT A 176 F 236 ASP A 129 ASP~? 7.83 O1 FMT A 176 H 110 ARG A 101 ARG~? 6.72 O2 FMT A 176 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 39.00 -16.21 -14.42 38.67 -18.83 -12.88 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR A 161 TYR~? 10.37 O2 FMT A 175 F 236 ASP A 166 ASP~? 5.39 O2 FMT A 176 H 110 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c23 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 78 ASP~? 43.27 O2 FMT A 175 A 261 ASP A 89 ASP~? 23.36 C FMT A 176 A 329 ASP A 80 ASP~? 35.02 C FMT A 176 coo 28.46 69.88 26.74 30.40 70.70 26.53 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 34.02 79.89 42.60 34.73 78.01 41.86 54.15 -9.18 -8.18 53.50 -9.22 -10.26 coo 37.87 70.12 31.80 36.61 69.74 30.15 64.20 -10.93 1.69 64.86 -11.65 -0.10 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 261 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 329 ASP A 119 ASP~? 7.68 O1 PEG A 177 coo 28.46 69.88 26.74 30.40 70.70 26.53 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 34.02 79.89 42.60 34.73 78.01 41.86 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 37.87 70.12 31.80 36.61 69.74 30.15 23.95 -13.44 -27.62 23.92 -11.77 -28.82 ULMN 3 1qho_c05 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 261 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 329 ASP A 166 ASP~? 5.39 O2 FMT A 176 coo 28.46 69.88 26.74 30.40 70.70 26.53 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 34.02 79.89 42.60 34.73 78.01 41.86 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 37.87 70.12 31.80 36.61 69.74 30.15 33.53 -18.89 -15.18 35.30 -18.02 -15.79 1qho_c05 source 1qho ALPHA-AMYLASE : 3 hits 1qho_c05 naa= 3 ULMN 3 1qho_c07 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 260 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 329 ASP A 110 ASP~? 7.00 O2 FMT A 174 coo 28.46 69.88 26.74 30.40 70.70 26.53 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 30.73 81.29 37.61 31.23 82.07 35.69 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 37.87 70.12 31.80 36.61 69.74 30.15 25.17 -6.99 -19.79 25.21 -6.55 -17.70 1qho_c07 source 1qho ALPHA-AMYLASE : 1 hits 1qho_c07 naa= 3 ULMN 3 1qz9_c02 KYNURENINASE user 1 3 # 1 A 129 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 201 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 227 LYS A 157 LYS~? 15.32 C FMT A 174 coo 23.39 49.81 32.16 21.33 51.68 32.26 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 25.52 45.12 37.98 23.98 46.65 37.85 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 12.68 46.83 36.69 18.26 48.67 34.51 20.67 -15.87 -11.19 14.43 -16.61 -10.33 1qz9_c02 source 1qz9 KYNURENINASE : 1 hits 1qz9_c02 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 35 SER A 94 SER~? 15.65 O2 FMT A 175 215 ASP A 89 ASP~? 23.36 C FMT A 176 coo 11.85 17.24 72.81 11.09 15.37 72.36 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 12.20 12.71 75.45 13.69 13.84 74.03 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 5.22 15.03 71.43 7.19 14.88 70.83 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 1 hits 1rne_c04 naa= 3 ULMN 3 1ro7_c03 ALPHA-2,3/8-SIALYLTRANSFERASE user 1 3 # 1 D 129 ARG A 107 ARG~? -5.14 O2 PEG A 177s D 156 TYR A 98 TYR~? 10.02 O2 FMT A 175 D 188 HIS A 103 HIS~? 8.30 O2 FMT A 174 coo -19.99 -38.81 30.91 -19.99 -39.90 28.04 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -32.96 -44.88 30.49 -32.31 -42.65 28.92 38.55 -12.80 -8.86 35.99 -13.04 -7.80 coo -25.33 -42.26 31.79 -24.77 -40.56 30.70 35.22 -6.46 -14.60 35.44 -5.32 -12.85 1ro7_c03 source 1ro7 ALPHA-2,3/8-SIALYLTRANSFERASE : 1 hits 1ro7_c03 naa= 3 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 A 137 GLU A 121 GLU~? 15.09 C1 PEG A 177 A 288 HIS A 144 HIS~? 21.24 O2 FMT A 174 A 329 LYS A 150 LYS~? 21.36 C FMT A 174 coo 29.27 18.78 14.99 27.16 18.62 14.76 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 49.52 10.06 10.36 50.99 9.65 8.92 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo 57.80 12.92 13.83 53.77 8.42 12.15 10.40 -5.89 -12.34 6.45 -10.45 -13.59 1roz_c00 source 1roz DEOXYHYPUSINE SYNTHASE : 1 hits 1roz_c00 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 92 ASP~? 21.45 O1 FMT A 174 595 GLU A 100 GLU~? 11.75 C4 PEG A 177 713 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 5.64 2.82 38.49 4.59 4.19 37.25 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 4.35 13.73 37.63 3.39 12.18 36.55 41.90 -9.49 -16.18 43.86 -10.09 -17.17 coo 3.76 10.25 31.38 3.16 9.87 34.10 38.55 -12.80 -8.86 35.99 -13.04 -7.80 ULMN 3 1sll_c00 SIALIDASE L user 2 3 # 2 318 ASP A 129 ASP~? 7.83 O1 FMT A 176 595 GLU A 164 GLU~? 5.82 O1 FMT A 175 713 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 5.64 2.82 38.49 4.59 4.19 37.25 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 4.35 13.73 37.63 3.39 12.18 36.55 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 3.76 10.25 31.38 3.16 9.87 34.10 23.82 -21.26 -14.80 24.13 -23.57 -16.35 ULMN 3 1sll_c00 SIALIDASE L user 3 3 # 3 318 ASP A 166 ASP~? 5.39 O2 FMT A 176 595 GLU A 100 GLU~? 11.75 C4 PEG A 177 713 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 5.64 2.82 38.49 4.59 4.19 37.25 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 4.35 13.73 37.63 3.39 12.18 36.55 41.90 -9.49 -16.18 43.86 -10.09 -17.17 coo 3.76 10.25 31.38 3.16 9.87 34.10 38.55 -12.80 -8.86 35.99 -13.04 -7.80 1sll_c00 source 1sll SIALIDASE L : 3 hits 1sll_c00 naa= 3 ULMN 3 1sme_c05 PLASMEPSIN II user 1 3 # 1 B 34 ASP A 92 ASP~? 21.45 O1 FMT A 174 B 37 SER A 94 SER~? 15.65 O2 FMT A 175 B 214 ASP A 89 ASP~? 23.36 C FMT A 176 coo 17.69 97.58 52.73 17.33 97.19 54.77 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 20.67 100.44 55.84 20.21 98.51 54.45 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 12.41 98.71 58.47 14.37 98.17 58.05 54.15 -9.18 -8.18 53.50 -9.22 -10.26 1sme_c05 source 1sme PLASMEPSIN II : 1 hits 1sme_c05 naa= 3 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 1 3 # 1 A 87 ARG A 67 ARG~? 43.16 O1 FMT A 174 A 89 HIS A 59 HIS~? 37.22 O1 FMT A 174 A 119 ASN A 62 ASN~? 34.62 O1 FMT A 174 coo 28.44 23.52 73.95 30.13 24.84 76.11 57.57 5.82 16.12 60.39 6.14 14.88 coo 21.34 20.13 69.47 22.14 19.11 71.12 50.17 1.75 17.58 51.60 1.04 18.95 coo 19.69 29.00 71.61 19.80 26.98 72.20 46.96 11.24 14.25 45.21 11.51 13.09 1smn_c00 source 1smn EXTRACELLULAR ENDONUCLEASE : 1 hits 1smn_c00 naa= 3 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 1 3 # 1 B 87 ARG A 67 ARG~? 43.16 O1 FMT A 174 B 89 HIS A 59 HIS~? 37.22 O1 FMT A 174 B 119 ASN A 62 ASN~? 34.62 O1 FMT A 174 coo -30.08 23.20 29.48 -31.80 24.60 27.35 57.57 5.82 16.12 60.39 6.14 14.88 coo -22.85 19.92 33.92 -23.63 18.94 32.24 50.17 1.75 17.58 51.60 1.04 18.95 coo -21.28 28.91 31.84 -21.35 26.90 31.17 46.96 11.24 14.25 45.21 11.51 13.09 1smn_c01 source 1smn EXTRACELLULAR ENDONUCLEASE : 1 hits 1smn_c01 naa= 3 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 1 3 # 1 B 8 HIS A 59 HIS~? 37.22 O1 FMT A 174 B 80 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 223 ARG A 96 ARG~? 20.74 C4 PEG A 177 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 50.17 1.75 17.58 51.60 1.04 18.95 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 52.13 -3.22 18.42 54.09 -2.61 19.04 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 46.88 -7.05 -12.28 49.48 -7.02 -10.60 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 2 3 # 2 B 8 HIS A 103 HIS~? 8.30 O2 FMT A 174 B 80 GLU A 106 GLU~? -4.32 O2 FMT A 174s B 223 ARG A 65 ARG~? 29.62 O1 FMT A 174 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 47.05 3.71 11.47 47.46 0.69 10.93 1t0u_c01 source 1t0u URIDINE PHOSPHORYLASE : 2 hits 1t0u_c01 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 114 ALA~? 10.03 O1 PEG A 177 A 251 GLY A 115 GLY~? 10.22 O1 PEG A 177 A 252 ASP A 116 ASP~? 12.69 O1 PEG A 177 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 20.00 -7.73 -24.16 20.99 -6.50 -24.22 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 20.38 -10.05 -27.18 19.80 -10.39 -26.64 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 18.27 -12.70 -29.95 19.69 -12.41 -31.48 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 # 2 A 250 ALA A 114 ALA~? 10.03 O1 PEG A 177 A 251 GLY A 115 GLY~? 10.22 O1 PEG A 177 A 252 ASP A 119 ASP~? 7.68 O1 PEG A 177 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 20.00 -7.73 -24.16 20.99 -6.50 -24.22 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 20.38 -10.05 -27.18 19.80 -10.39 -26.64 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 23.95 -13.44 -27.62 23.92 -11.77 -28.82 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 2 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA A 114 ALA~? 10.03 O1 PEG A 177 B 251 GLY A 115 GLY~? 10.22 O1 PEG A 177 B 252 ASP A 116 ASP~? 12.69 O1 PEG A 177 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 20.00 -7.73 -24.16 20.99 -6.50 -24.22 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 20.38 -10.05 -27.18 19.80 -10.39 -26.64 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 18.27 -12.70 -29.95 19.69 -12.41 -31.48 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 # 2 B 250 ALA A 114 ALA~? 10.03 O1 PEG A 177 B 251 GLY A 115 GLY~? 10.22 O1 PEG A 177 B 252 ASP A 119 ASP~? 7.68 O1 PEG A 177 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 20.00 -7.73 -24.16 20.99 -6.50 -24.22 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 20.38 -10.05 -27.18 19.80 -10.39 -26.64 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 23.95 -13.44 -27.62 23.92 -11.77 -28.82 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 2 hits 1tz3_c03 naa= 3 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 A 46 GLU A 55 GLU~? 39.06 O1 FMT A 174 A 126 LYS A 51 LYS~? 41.76 O1 FMT A 175 A 171 ALA A 56 ALA~? 31.67 O1 FMT A 174 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 49.59 -2.49 14.39 49.76 -2.66 12.80 1uf7_c00 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 1 hits 1uf7_c00 naa= 3 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 B 46 GLU A 55 GLU~? 39.06 O1 FMT A 174 B 126 LYS A 51 LYS~? 41.76 O1 FMT A 175 B 171 ALA A 56 ALA~? 31.67 O1 FMT A 174 coo 20.47 87.42 16.54 20.16 87.17 14.45 52.13 -3.22 18.42 54.09 -2.61 19.04 coo 24.73 94.37 14.59 21.08 89.84 11.98 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 24.38 86.32 12.71 22.88 86.54 12.71 49.59 -2.49 14.39 49.76 -2.66 12.80 1uf7_c01 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 1 hits 1uf7_c01 naa= 3 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 # 1 A 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 596 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 647 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 69.13 32.20 28.58 68.39 32.96 30.44 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 70.89 37.31 29.70 69.54 36.29 32.39 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 66.09 40.54 34.70 66.92 37.69 35.49 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 2 3 # 2 A 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 647 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 69.13 32.20 28.58 68.39 32.96 30.44 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 70.89 37.31 29.70 69.54 36.29 32.39 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 66.09 40.54 34.70 66.92 37.69 35.49 20.90 -10.04 -7.22 20.67 -7.48 -5.33 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 3 3 # 3 A 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s A 647 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 69.13 32.20 28.58 68.39 32.96 30.44 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 70.89 37.31 29.70 69.54 36.29 32.39 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 66.09 40.54 34.70 66.92 37.69 35.49 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 4 3 # 4 A 581 GLU A 121 GLU~? 15.09 C1 PEG A 177 A 596 ARG A 132 ARG~? 15.71 O4 PEG A 177 A 647 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 69.13 32.20 28.58 68.39 32.96 30.44 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 70.89 37.31 29.70 69.54 36.29 32.39 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 66.09 40.54 34.70 66.92 37.69 35.49 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1v0e_c00 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c00 naa= 3 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 # 1 B 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s B 596 ARG A 107 ARG~? -5.14 O2 PEG A 177s B 647 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 38.22 57.83 70.36 36.82 56.74 69.18 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 34.24 60.89 68.08 33.31 57.93 67.63 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 31.43 57.38 61.97 31.90 55.58 64.41 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 2 3 # 2 B 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s B 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s B 647 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 38.22 57.83 70.36 36.82 56.74 69.18 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 34.24 60.89 68.08 33.31 57.93 67.63 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 31.43 57.38 61.97 31.90 55.58 64.41 20.90 -10.04 -7.22 20.67 -7.48 -5.33 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 3 3 # 3 B 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s B 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s B 647 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 38.22 57.83 70.36 36.82 56.74 69.18 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 34.24 60.89 68.08 33.31 57.93 67.63 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 31.43 57.38 61.97 31.90 55.58 64.41 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 4 3 # 4 B 581 GLU A 121 GLU~? 15.09 C1 PEG A 177 B 596 ARG A 132 ARG~? 15.71 O4 PEG A 177 B 647 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 38.22 57.83 70.36 36.82 56.74 69.18 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 34.24 60.89 68.08 33.31 57.93 67.63 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 31.43 57.38 61.97 31.90 55.58 64.41 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1v0e_c01 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c01 naa= 3 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 # 1 C 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s C 596 ARG A 107 ARG~? -5.14 O2 PEG A 177s C 647 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 11.31 31.26 27.00 13.31 30.71 26.58 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 13.44 32.78 22.07 15.56 30.91 23.37 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 21.00 33.35 22.82 19.83 30.82 24.09 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 2 3 # 2 C 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s C 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s C 647 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 11.31 31.26 27.00 13.31 30.71 26.58 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 13.44 32.78 22.07 15.56 30.91 23.37 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 21.00 33.35 22.82 19.83 30.82 24.09 20.90 -10.04 -7.22 20.67 -7.48 -5.33 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 3 3 # 3 C 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s C 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s C 647 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 11.31 31.26 27.00 13.31 30.71 26.58 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 13.44 32.78 22.07 15.56 30.91 23.37 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 21.00 33.35 22.82 19.83 30.82 24.09 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 4 3 # 4 C 581 GLU A 121 GLU~? 15.09 C1 PEG A 177 C 596 ARG A 132 ARG~? 15.71 O4 PEG A 177 C 647 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 11.31 31.26 27.00 13.31 30.71 26.58 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 13.44 32.78 22.07 15.56 30.91 23.37 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 21.00 33.35 22.82 19.83 30.82 24.09 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1v0e_c02 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c02 naa= 3 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 # 1 D 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s D 596 ARG A 107 ARG~? -5.14 O2 PEG A 177s D 647 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 2 3 # 2 D 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s D 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s D 647 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 20.90 -10.04 -7.22 20.67 -7.48 -5.33 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 3 3 # 3 D 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s D 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s D 647 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 4 3 # 4 D 581 GLU A 121 GLU~? 15.09 C1 PEG A 177 D 596 ARG A 132 ARG~? 15.71 O4 PEG A 177 D 647 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1v0e_c03 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c03 naa= 3 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 # 1 E 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s E 596 ARG A 107 ARG~? -5.14 O2 PEG A 177s E 647 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo 13.14 -15.80 20.26 11.08 -15.36 20.42 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 2 3 # 2 E 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s E 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s E 647 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 3 3 # 3 E 581 GLU A 121 GLU~? 15.09 C1 PEG A 177 E 596 ARG A 132 ARG~? 15.71 O4 PEG A 177 E 647 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo 13.14 -15.80 20.26 11.08 -15.36 20.42 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1v0e_c04 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c04 naa= 3 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 # 1 F 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s F 596 ARG A 107 ARG~? -5.14 O2 PEG A 177s F 647 ARG A 111 ARG~? -4.31 O1 PEG A 177s coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 27.44 -10.86 -26.00 28.74 -11.94 -28.55 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 2 3 # 2 F 581 GLU A 106 GLU~? -4.32 O2 FMT A 174s F 596 ARG A 109 ARG~? -3.22 O2 FMT A 174s F 647 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 24.40 -10.07 -15.09 26.17 -7.77 -14.09 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 3 3 # 3 F 581 GLU A 121 GLU~? 15.09 C1 PEG A 177 F 596 ARG A 132 ARG~? 15.71 O4 PEG A 177 F 647 ARG A 136 ARG~? -19.53 O1 PEG A 177s coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 23.47 -20.47 -31.08 23.01 -22.26 -29.87 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 21.56 -24.77 -26.82 24.40 -25.49 -27.78 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 16.63 -21.80 -25.68 14.14 -20.50 -26.99 1v0e_c05 source 1v0e ENDO-ALPHA-SIALIDASE : 3 hits 1v0e_c05 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 127 TYR~? 5.76 O2 FMT A 176 A 317 GLU A 126 GLU~? 5.29 O4 PEG A 177 A 365 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 1.77 6.56 57.05 3.05 7.44 59.37 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 3.06 2.85 52.79 4.83 3.89 53.24 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 3.82 17.09 49.56 4.09 14.32 50.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1vzx_c02 2.04.01.0087 user 2 3 # 2 A 314 TYR A 127 TYR~? 5.76 O2 FMT A 176 A 317 GLU A 126 GLU~? 5.29 O4 PEG A 177 A 365 ARG A 132 ARG~? 15.71 O4 PEG A 177 coo 1.77 6.56 57.05 3.05 7.44 59.37 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 3.06 2.85 52.79 4.83 3.89 53.24 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 3.82 17.09 49.56 4.09 14.32 50.84 21.56 -24.77 -26.82 24.40 -25.49 -27.78 ULMN 3 1vzx_c02 2.04.01.0087 user 3 3 # 3 A 314 TYR A 127 TYR~? 5.76 O2 FMT A 176 A 317 GLU A 126 GLU~? 5.29 O4 PEG A 177 A 365 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 1.77 6.56 57.05 3.05 7.44 59.37 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 3.06 2.85 52.79 4.83 3.89 53.24 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 3.82 17.09 49.56 4.09 14.32 50.84 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1vzx_c02 2.04.01.0087 user 4 3 # 4 A 314 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 317 GLU A 164 GLU~? 5.82 O1 FMT A 175 A 365 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 1.77 6.56 57.05 3.05 7.44 59.37 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 3.06 2.85 52.79 4.83 3.89 53.24 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 3.82 17.09 49.56 4.09 14.32 50.84 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1vzx_c02 2.04.01.0087 user 5 3 # 5 A 314 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 317 GLU A 164 GLU~? 5.82 O1 FMT A 175 A 365 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 1.77 6.56 57.05 3.05 7.44 59.37 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 3.06 2.85 52.79 4.83 3.89 53.24 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 3.82 17.09 49.56 4.09 14.32 50.84 20.90 -10.04 -7.22 20.67 -7.48 -5.33 1vzx_c02 source 1vzx 2.04.01.0087 : 5 hits 1vzx_c02 naa= 3 ULMN 3 1vzx_c03 2.04.01.0087 user 1 3 # 1 B1314 TYR A 127 TYR~? 5.76 O2 FMT A 176 B1317 GLU A 126 GLU~? 5.29 O4 PEG A 177 B1365 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 13.32 10.15 -9.20 12.07 11.36 -11.38 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1vzx_c03 2.04.01.0087 user 2 3 # 2 B1314 TYR A 127 TYR~? 5.76 O2 FMT A 176 B1317 GLU A 126 GLU~? 5.29 O4 PEG A 177 B1365 ARG A 132 ARG~? 15.71 O4 PEG A 177 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 21.56 -24.77 -26.82 24.40 -25.49 -27.78 ULMN 3 1vzx_c03 2.04.01.0087 user 3 3 # 3 B1314 TYR A 127 TYR~? 5.76 O2 FMT A 176 B1317 GLU A 126 GLU~? 5.29 O4 PEG A 177 B1365 ARG A 163 ARG~? 6.61 O2 FMT A 175 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 31.30 -20.95 -20.60 32.94 -18.93 -19.47 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 33.17 -18.08 -25.75 34.94 -18.65 -26.89 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 30.03 -15.29 -9.70 32.00 -14.53 -7.50 ULMN 3 1vzx_c03 2.04.01.0087 user 4 3 # 4 B1314 TYR A 161 TYR~? 10.37 O2 FMT A 175 B1317 GLU A 164 GLU~? 5.82 O1 FMT A 175 B1365 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 13.32 10.15 -9.20 12.07 11.36 -11.38 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 1vzx_c03 2.04.01.0087 user 5 3 # 5 B1314 TYR A 161 TYR~? 10.37 O2 FMT A 175 B1317 GLU A 164 GLU~? 5.82 O1 FMT A 175 B1365 ARG A 156 ARG~? 7.82 O1 FMT A 174 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 27.84 -22.33 -10.08 25.81 -22.69 -9.75 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 20.90 -10.04 -7.22 20.67 -7.48 -5.33 1vzx_c03 source 1vzx 2.04.01.0087 : 5 hits 1vzx_c03 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 40 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 103 LEU A 165 LEU~? -7.26 O2 FMT A 176s coo 12.09 16.13 10.57 11.28 18.80 10.73 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 7.55 25.51 14.34 9.65 25.73 14.24 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 11.83 18.73 16.99 10.99 19.71 15.26 29.59 -22.25 -16.75 27.66 -23.11 -17.39 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 1 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 161 TYR~? 10.37 O2 FMT A 175 B 40 ASP A 129 ASP~? 7.83 O1 FMT A 176 B 103 LEU A 165 LEU~? -7.26 O2 FMT A 176s coo 14.25 20.09 37.35 13.48 17.40 37.38 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 9.39 10.77 34.53 11.50 10.63 34.41 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 12.89 17.60 31.13 12.34 16.51 32.90 29.59 -22.25 -16.75 27.66 -23.11 -17.39 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 1 hits 1vzz_c01 naa= 3 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 1 3 # 1 A 105 HIS A 103 HIS~? 8.30 O2 FMT A 174 A 169 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 288 GLU A 164 GLU~? 5.82 O1 FMT A 175 coo 67.72 35.99 30.87 69.77 36.13 31.33 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 73.17 30.66 22.56 72.87 30.30 20.46 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 74.06 28.51 15.92 73.77 29.56 17.73 27.84 -22.33 -10.08 25.81 -22.69 -9.75 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 2 3 # 2 A 105 HIS A 103 HIS~? 8.30 O2 FMT A 174 A 169 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 288 GLU A 167 GLU~? -4.28 O1 FMT A 176s coo 67.72 35.99 30.87 69.77 36.13 31.33 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 73.17 30.66 22.56 72.87 30.30 20.46 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 74.06 28.51 15.92 73.77 29.56 17.73 35.33 -23.68 -13.20 34.70 -25.59 -12.86 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 2 hits 1w1o_c00 naa= 3 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 420 ALA A 24 ALA~? 34.25 O1 FMT A 174 B 182 GLY A 29 GLY~? 31.67 O1 FMT A 174 B 183 GLY A 73 GLY~? 37.04 O1 FMT A 174 coo 38.36-101.47-135.52 39.62-101.29-136.35 58.09 3.11 -1.09 59.14 2.87 -2.21 coo 41.93-102.35-126.87 41.52-101.89-126.30 55.06 -1.63 5.08 54.44 -1.45 4.54 coo 38.37-101.99-128.11 38.63-102.24-127.37 59.22 1.39 7.46 59.46 0.96 8.10 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 420 ALA A 24 ALA~? 34.25 O1 FMT A 174 B 182 GLY A 73 GLY~? 37.04 O1 FMT A 174 B 183 GLY A 29 GLY~? 31.67 O1 FMT A 174 coo 38.36-101.47-135.52 39.62-101.29-136.35 58.09 3.11 -1.09 59.14 2.87 -2.21 coo 41.93-102.35-126.87 41.52-101.89-126.30 59.22 1.39 7.46 59.46 0.96 8.10 coo 38.37-101.99-128.11 38.63-102.24-127.37 55.06 -1.63 5.08 54.44 -1.45 4.54 1xny_c01 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 2 hits 1xny_c01 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 54 ALA~? 32.98 O1 FMT A 175 B 126 ARG A 50 ARG~? 30.44 C FMT A 175 B 138 GLU A 55 GLU~? 39.06 O1 FMT A 174 coo 2.11 4.00 19.31 3.14 4.86 19.99 50.28 -7.90 14.99 50.63 -9.22 15.77 coo 2.45 5.53 11.28 3.59 7.56 13.29 56.17 -13.83 11.47 55.95 -14.59 8.45 coo 6.10 2.00 25.24 6.12 1.84 23.13 52.13 -3.22 18.42 54.09 -2.61 19.04 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 54 ALA~? 32.98 O1 FMT A 175 C 126 ARG A 50 ARG~? 30.44 C FMT A 175 C 138 GLU A 55 GLU~? 39.06 O1 FMT A 174 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 50.28 -7.90 14.99 50.63 -9.22 15.77 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 56.17 -13.83 11.47 55.95 -14.59 8.45 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 52.13 -3.22 18.42 54.09 -2.61 19.04 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 54 ALA~? 32.98 O1 FMT A 175 D 126 ARG A 50 ARG~? 30.44 C FMT A 175 D 138 GLU A 55 GLU~? 39.06 O1 FMT A 174 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 50.28 -7.90 14.99 50.63 -9.22 15.77 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 56.17 -13.83 11.47 55.95 -14.59 8.45 coo 6.23 0.50 57.10 5.93 0.72 59.19 52.13 -3.22 18.42 54.09 -2.61 19.04 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 54 ALA~? 32.98 O1 FMT A 175 E 126 ARG A 50 ARG~? 30.44 C FMT A 175 E 138 GLU A 55 GLU~? 39.06 O1 FMT A 174 coo -4.56 10.03 62.36 -4.38 11.31 61.55 50.28 -7.90 14.99 50.63 -9.22 15.77 coo -3.02 12.00 70.07 -1.94 13.84 67.82 56.17 -13.83 11.47 55.95 -14.59 8.45 coo -8.67 12.22 56.54 -8.68 12.09 58.65 52.13 -3.22 18.42 54.09 -2.61 19.04 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 54 ALA~? 32.98 O1 FMT A 175 F 126 ARG A 50 ARG~? 30.44 C FMT A 175 F 138 GLU A 55 GLU~? 39.06 O1 FMT A 174 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 50.28 -7.90 14.99 50.63 -9.22 15.77 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 56.17 -13.83 11.47 55.95 -14.59 8.45 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 52.13 -3.22 18.42 54.09 -2.61 19.04 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c11 naa= 3 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP A 47 ASP~? 38.21 O1 FMT A 175 A 371 LYS A 51 LYS~? 41.76 O1 FMT A 175 A 407 THR A 46 THR~? 38.59 O2 FMT A 175 coo -5.17 31.09 15.73 -7.07 31.12 16.73 60.78 -12.55 15.33 61.00 -14.73 15.19 coo -4.43 30.92 22.89 -6.61 31.91 19.71 55.36 -8.57 15.97 57.03 -6.97 21.56 coo -8.38 36.02 19.06 -8.83 34.10 19.89 61.69 -11.20 10.63 63.04 -9.44 10.35 1zrz_c02 source 1zrz PROTEIN KINASE C, IOTA : 1 hits 1zrz_c02 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 108 TRP~? -4.03 C1 PEG A 177s 223 ASP A 110 ASP~? 7.00 O2 FMT A 174 258 ALA A 118 ALA~? 11.64 O1 PEG A 177 coo 128.40 33.01 26.67 128.12 36.28 28.81 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 127.91 41.73 23.55 129.18 40.35 24.44 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 141.00 37.49 25.74 139.80 37.53 24.78 22.80 -15.75 -31.66 22.91 -14.62 -32.69 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP A 108 TRP~? -4.03 C1 PEG A 177s 223 ASP A 119 ASP~? 7.68 O1 PEG A 177 258 ALA A 130 ALA~? 10.57 O2 FMT A 176 coo 128.40 33.01 26.67 128.12 36.28 28.81 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 127.91 41.73 23.55 129.18 40.35 24.44 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 141.00 37.49 25.74 139.80 37.53 24.78 26.26 -25.01 -20.40 26.12 -23.73 -21.18 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 2 hits 2aat_c01 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 78 ASP~? 43.27 O2 FMT A 175 231 ASP A 89 ASP~? 23.36 C FMT A 176 294 ASP A 47 ASP~? 38.21 O1 FMT A 175 coo 27.89 102.52 14.98 29.35 101.92 13.57 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 14.74 93.05 -1.00 14.30 94.22 0.73 54.15 -9.18 -8.18 53.50 -9.22 -10.26 coo 33.16 106.80 7.72 33.34 104.87 6.92 60.78 -12.55 15.33 61.00 -14.73 15.19 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP A 78 ASP~? 43.27 O2 FMT A 175 231 ASP A 92 ASP~? 21.45 O1 FMT A 174 294 ASP A 47 ASP~? 38.21 O1 FMT A 175 coo 27.89 102.52 14.98 29.35 101.92 13.57 65.63 -6.29 9.14 66.97 -5.21 10.41 coo 14.74 93.05 -1.00 14.30 94.22 0.73 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 33.16 106.80 7.72 33.34 104.87 6.92 60.78 -12.55 15.33 61.00 -14.73 15.19 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 2 hits 2amg_c06 naa= 3 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 3 # 1 35 ASP A 92 ASP~? 21.45 O1 FMT A 174 38 SER A 94 SER~? 15.65 O2 FMT A 175 218 ASP A 89 ASP~? 23.36 C FMT A 176 coo 41.14 58.72 105.19 42.39 59.85 103.92 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo 46.04 57.35 103.96 44.97 58.52 105.78 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 41.33 60.20 97.63 42.00 60.96 99.49 54.15 -9.18 -8.18 53.50 -9.22 -10.26 2apr_c04 source 2apr ACID PROTEINASE (RHIZOPUSPEPSIN) (E.C.3.4.23.6: 1 hits 2apr_c04 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 161 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG A 136 ARG~? -19.53 O1 PEG A 177s A 161 ASP A 129 ASP~? 7.83 O1 FMT A 176 A 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 16.63 -21.80 -25.68 14.14 -20.50 -26.99 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 3 3 # 3 A 14 ARG A 140 ARG~? -21.39 O1 PEG A 177s A 161 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 174 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 10.76 -17.91 -21.91 12.11 -20.58 -22.47 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 23.82 -21.26 -14.80 24.13 -23.57 -16.35 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 107 ARG~? -5.14 O2 PEG A 177s B 161 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -14.86 10.19 8.14 -14.82 12.31 8.42 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -21.46 12.70 8.53 -19.04 12.30 7.24 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG A 136 ARG~? -19.53 O1 PEG A 177s B 161 ASP A 129 ASP~? 7.83 O1 FMT A 176 B 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 16.63 -21.80 -25.68 14.14 -20.50 -26.99 coo -14.86 10.19 8.14 -14.82 12.31 8.42 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo -21.46 12.70 8.53 -19.04 12.30 7.24 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 3 3 # 3 B 14 ARG A 140 ARG~? -21.39 O1 PEG A 177s B 161 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 174 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 10.76 -17.91 -21.91 12.11 -20.58 -22.47 coo -14.86 10.19 8.14 -14.82 12.31 8.42 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo -21.46 12.70 8.53 -19.04 12.30 7.24 23.82 -21.26 -14.80 24.13 -23.57 -16.35 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 107 ARG~? -5.14 O2 PEG A 177s C 161 ASP A 166 ASP~? 5.39 O2 FMT A 176 C 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 2.84 19.43 40.34 1.59 20.35 37.65 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -0.62 11.10 28.05 -0.65 13.15 27.46 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 5.94 13.28 27.17 3.53 13.05 28.58 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG A 136 ARG~? -19.53 O1 PEG A 177s C 161 ASP A 129 ASP~? 7.83 O1 FMT A 176 C 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo 2.84 19.43 40.34 1.59 20.35 37.65 16.63 -21.80 -25.68 14.14 -20.50 -26.99 coo -0.62 11.10 28.05 -0.65 13.15 27.46 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo 5.94 13.28 27.17 3.53 13.05 28.58 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 3 3 # 3 C 14 ARG A 140 ARG~? -21.39 O1 PEG A 177s C 161 ASP A 131 ASP~? 16.41 O2 FMT A 176 C 174 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo 2.84 19.43 40.34 1.59 20.35 37.65 10.76 -17.91 -21.91 12.11 -20.58 -22.47 coo -0.62 11.10 28.05 -0.65 13.15 27.46 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 5.94 13.28 27.17 3.53 13.05 28.58 23.82 -21.26 -14.80 24.13 -23.57 -16.35 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG A 107 ARG~? -5.14 O2 PEG A 177s D 161 ASP A 166 ASP~? 5.39 O2 FMT A 176 D 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG A 136 ARG~? -19.53 O1 PEG A 177s D 161 ASP A 129 ASP~? 7.83 O1 FMT A 176 D 174 TYR A 127 TYR~? 5.76 O2 FMT A 176 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 16.63 -21.80 -25.68 14.14 -20.50 -26.99 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 29.91 -28.16 -19.91 31.33 -29.73 -20.56 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 31.30 -20.95 -20.60 32.94 -18.93 -19.47 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 3 3 # 3 D 14 ARG A 140 ARG~? -21.39 O1 PEG A 177s D 161 ASP A 131 ASP~? 16.41 O2 FMT A 176 D 174 TYR A 161 TYR~? 10.37 O2 FMT A 175 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 10.76 -17.91 -21.91 12.11 -20.58 -22.47 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 23.82 -21.26 -14.80 24.13 -23.57 -16.35 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c11 naa= 3 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 1 3 # 1 A 197 ASP A 110 ASP~? 7.00 O2 FMT A 174 A 233 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 300 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo 12.51 17.07 49.46 12.44 16.89 47.35 25.17 -6.99 -19.79 25.21 -6.55 -17.70 coo 6.52 19.14 48.16 7.77 18.42 46.61 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 9.30 22.40 41.76 10.10 20.96 40.36 35.06 -12.01 -19.02 34.43 -13.28 -20.72 2cpu_c01 source 2cpu ALPHA-AMYLASE : 1 hits 2cpu_c01 naa= 3 ULMN 3 2jxr_c04 LIGAND CP-081282 user 1 3 # 1 A 32 ASP A 92 ASP~? 21.45 O1 FMT A 174 A 35 SER A 94 SER~? 15.65 O2 FMT A 175 A 215 ASP A 89 ASP~? 23.36 C FMT A 176 coo -14.00 61.45 43.99 -14.19 63.14 42.84 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo -13.21 66.21 45.84 -15.49 65.90 45.84 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo -10.72 64.19 37.77 -12.20 64.43 39.15 54.15 -9.18 -8.18 53.50 -9.22 -10.26 2jxr_c04 source 2jxr LIGAND CP-081282 : 1 hits 2jxr_c04 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 102 PHE~? 5.11 C FMT A 174 A 263 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 51.51 50.32 16.39 52.13 49.68 13.75 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 54.43 44.82 23.74 55.21 45.06 21.80 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 63.95 45.30 16.71 59.11 49.15 16.05 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 263 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 51.51 50.32 16.39 52.13 49.68 13.75 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 54.43 44.82 23.74 55.21 45.06 21.80 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 63.95 45.30 16.71 59.11 49.15 16.05 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 A 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 263 ASP A 131 ASP~? 16.41 O2 FMT A 176 A 292 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 51.51 50.32 16.39 52.13 49.68 13.75 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 54.43 44.82 23.74 55.21 45.06 21.80 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 63.95 45.30 16.71 59.11 49.15 16.05 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 A 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 A 263 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 51.51 50.32 16.39 52.13 49.68 13.75 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 54.43 44.82 23.74 55.21 45.06 21.80 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 63.95 45.30 16.71 59.11 49.15 16.05 20.67 -15.87 -11.19 14.43 -16.61 -10.33 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 4 hits 2oat_c03 naa= 3 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 263 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 49.99 26.05 6.28 51.46 26.87 8.49 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 60.53 31.67 0.97 57.79 27.51 3.63 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 B 263 ASP A 131 ASP~? 16.41 O2 FMT A 176 B 292 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 49.99 26.05 6.28 51.46 26.87 8.49 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 60.53 31.67 0.97 57.79 27.51 3.63 25.45 -16.84 -10.59 23.78 -19.75 -6.08 2oat_c04 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c04 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 102 PHE~? 5.11 C FMT A 174 C 263 ASP A 166 ASP~? 5.39 O2 FMT A 176 C 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 33.54 -10.18 -11.15 31.30 -9.31 -9.58 coo 19.84 12.02 9.33 18.68 11.23 7.75 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 12.82 3.49 4.98 17.80 5.59 1.90 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 C 263 ASP A 131 ASP~? 16.41 O2 FMT A 176 C 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 19.84 12.02 9.33 18.68 11.23 7.75 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 12.82 3.49 4.98 17.80 5.59 1.90 20.67 -15.87 -11.19 14.43 -16.61 -10.33 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 C 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 C 263 ASP A 131 ASP~? 16.41 O2 FMT A 176 C 292 LYS A 160 LYS~? 7.79 O1 FMT A 175 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 19.84 12.02 9.33 18.68 11.23 7.75 22.06 -26.63 -18.59 20.10 -27.49 -18.71 coo 12.82 3.49 4.98 17.80 5.59 1.90 25.45 -16.84 -10.59 23.78 -19.75 -6.08 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 C 177 PHE A 123 PHE~? 8.93 O4 PEG A 177 C 263 ASP A 166 ASP~? 5.39 O2 FMT A 176 C 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 27.36 -18.11 -22.75 28.00 -18.90 -20.15 coo 19.84 12.02 9.33 18.68 11.23 7.75 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 12.82 3.49 4.98 17.80 5.59 1.90 20.67 -15.87 -11.19 14.43 -16.61 -10.33 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 4 hits 2oat_c05 naa= 3 ULMN 3 2oat_c06 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 178 TRP A 108 TRP~? -4.03 C1 PEG A 177s A 263 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 48.96 45.07 19.49 48.62 41.39 18.16 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 54.43 44.82 23.74 55.21 45.06 21.80 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 63.95 45.30 16.71 59.11 49.15 16.05 20.67 -15.87 -11.19 14.43 -16.61 -10.33 2oat_c06 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c06 naa= 3 ULMN 3 2oat_c08 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 178 TRP A 108 TRP~? -4.03 C1 PEG A 177s C 263 ASP A 166 ASP~? 5.39 O2 FMT A 176 C 292 LYS A 157 LYS~? 15.32 C FMT A 174 coo 20.52 16.65 4.15 17.32 18.91 4.39 31.06 -14.33 -21.75 29.41 -14.60 -25.34 coo 19.84 12.02 9.33 18.68 11.23 7.75 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 12.82 3.49 4.98 17.80 5.59 1.90 20.67 -15.87 -11.19 14.43 -16.61 -10.33 2oat_c08 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c08 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 47 ASP~? 38.21 O1 FMT A 175 A 151 LYS A 51 LYS~? 41.76 O1 FMT A 175 A 186 THR A 46 THR~? 38.59 O2 FMT A 175 coo 41.42 17.90 44.98 43.39 18.36 45.61 60.78 -12.55 15.33 61.00 -14.73 15.19 coo 45.75 16.58 39.61 47.43 18.26 45.54 55.36 -8.57 15.97 57.03 -6.97 21.56 coo 45.88 23.02 44.72 46.99 21.16 44.68 61.69 -11.20 10.63 63.04 -9.44 10.35 2phk_c02 source 2phk MC-PEPTIDE : 1 hits 2phk_c02 naa= 3 ULMN 3 2tpl_c04 TYROSINE PHENOL-LYASE user 1 3 # 1 A 122 TYR A 98 TYR~? 10.02 O2 FMT A 175 A 214 ASP A 166 ASP~? 5.39 O2 FMT A 176 A 256 LYS A 157 LYS~? 15.32 C FMT A 174 coo -36.51 -15.34 5.35 -36.90 -16.76 7.69 38.55 -12.80 -8.86 35.99 -13.04 -7.80 coo -29.95 -11.32 -1.46 -28.83 -11.55 0.31 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -18.13 -8.46 4.26 -20.75 -6.32 9.36 20.67 -15.87 -11.19 14.43 -16.61 -10.33 2tpl_c04 source 2tpl TYROSINE PHENOL-LYASE : 1 hits 2tpl_c04 naa= 3 ULMN 3 2tpl_c05 TYROSINE PHENOL-LYASE user 1 3 # 1 B 122 TYR A 98 TYR~? 10.02 O2 FMT A 175 B 214 ASP A 166 ASP~? 5.39 O2 FMT A 176 B 256 LYS A 157 LYS~? 15.32 C FMT A 174 coo -32.67 22.74 10.17 -32.85 23.98 7.70 38.55 -12.80 -8.86 35.99 -13.04 -7.80 coo -26.88 17.61 16.89 -26.08 17.11 15.00 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo -16.04 12.06 11.09 -17.97 10.54 5.71 20.67 -15.87 -11.19 14.43 -16.61 -10.33 2tpl_c05 source 2tpl TYROSINE PHENOL-LYASE : 1 hits 2tpl_c05 naa= 3 ULMN 3 7atj_c00 PEROXIDASE C1A user 1 3 # 1 A 38 ARG A 107 ARG~? -5.14 O2 PEG A 177s A 42 HIS A 103 HIS~? 8.30 O2 FMT A 174 A 70 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo 1.39 6.34 11.43 0.09 6.19 8.61 32.48 -6.37 -21.24 35.08 -7.16 -19.82 coo 5.40 8.25 8.15 4.09 6.62 7.93 35.22 -6.46 -14.60 35.44 -5.32 -12.85 coo 1.54 10.80 4.23 3.44 10.57 5.15 35.06 -12.01 -19.02 34.43 -13.28 -20.72 7atj_c00 source 7atj PEROXIDASE C1A : 1 hits 7atj_c00 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 62 ASN~? 34.62 O1 FMT A 174 coo 5.80 63.03 55.85 5.52 65.03 56.45 46.96 11.24 14.25 45.21 11.51 13.09 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 99 ASN~? 12.05 O2 FMT A 174 coo 5.80 63.03 55.85 5.52 65.03 56.45 39.44 -8.04 -11.63 39.55 -7.84 -9.53 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 104 ASN~? -3.09 C4 PEG A 177s coo 5.80 63.03 55.85 5.52 65.03 56.45 35.06 -12.01 -19.02 34.43 -13.28 -20.72 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 149 ASN~? 18.67 O2 FMT A 174 coo 5.80 63.03 55.85 5.52 65.03 56.45 9.69 -1.91 -15.42 10.65 -0.44 -14.11 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 4 hits 1kbk_p00 naa= 1 ULMN 3 2p3i_p00 VP4 user 1 3 # 1 A 101 ARG A 96 ARG~? 20.74 C4 PEG A 177 A 188 TYR A 98 TYR~? 10.02 O2 FMT A 175 A 190 SER A 94 SER~? 15.65 O2 FMT A 175 coo 37.69 7.64 13.51 38.82 8.84 16.11 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 47.14 12.10 13.73 48.75 12.33 16.01 38.55 -12.80 -8.86 35.99 -13.04 -7.80 coo 43.77 6.93 15.46 45.49 7.21 17.11 45.82 -13.49 -9.13 45.45 -14.29 -6.96 2p3i_p00 source 2p3i VP4 : 1 hits 2p3i_p00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 57 PRO~? 30.63 O1 FMT A 174 A 272 LEU A 53 LEU~? 31.94 O2 FMT A 175 A 276 ARG A 50 ARG~? 30.44 C FMT A 175 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 45.82 -4.76 14.81 46.47 -2.54 14.89 coo 10.97 0.43 16.73 11.31 2.11 18.06 52.72 -7.07 11.18 53.53 -6.61 9.12 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 56.17 -13.83 11.47 55.95 -14.59 8.45 1emh_d00 source 1emh HYDROLASE/DNA : 1 hits 1emh_d00 naa= 3 ULMN 4 1pt3_d00 HYDROLASE/DNA user 1 4 # 1 A 493 ASP A 119 ASP~? 7.68 O1 PEG A 177 A 496 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 497 LYS A 122 LYS~? 10.14 O4 PEG A 177 A 538 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 15.86 25.80 6.36 15.63 24.95 4.48 23.95 -13.44 -27.62 23.92 -11.77 -28.82 coo 13.63 31.13 3.81 13.19 28.14 4.37 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 13.35 31.27 9.53 12.86 25.24 10.46 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo 9.10 29.26 -6.38 11.11 30.45 -8.37 24.40 -10.07 -15.09 26.17 -7.77 -14.09 1pt3_d00 source 1pt3 HYDROLASE/DNA : 1 hits 1pt3_d00 naa= 4 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 1 3 # 1 A 40 LYS A 160 LYS~? 7.79 O1 FMT A 175 A 41 LYS A 157 LYS~? 15.32 C FMT A 174 A 42 ILE A 158 ILE~? 10.62 C FMT A 174 coo 36.07 63.73 124.22 32.72 60.75 122.39 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 38.49 66.12 125.64 35.69 66.71 131.25 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo 41.08 63.27 123.17 40.13 62.43 122.44 21.81 -14.91 -15.86 21.31 -14.74 -17.13 1pyi_d00 source 1pyi PROTEIN (PYRIMIDINE PATHWAY REGULATOR 1) : 1 hits 1pyi_d00 naa= 3 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 563 LYS A 122 LYS~? 10.14 O4 PEG A 177 A 564 VAL A 124 VAL~? 11.64 O4 PEG A 177 A 568 ARG A 132 ARG~? 15.71 O4 PEG A 177 coo -6.60 80.79 55.64 -8.55 79.48 61.01 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo -9.25 78.14 55.31 -11.11 77.94 56.39 27.74 -21.97 -25.35 25.89 -23.13 -25.42 coo -12.31 74.86 52.32 -13.99 74.91 54.92 21.56 -24.77 -26.82 24.40 -25.49 -27.78 1r4i_d00 source 1r4i TRANSCRIPTION/DNA : 1 hits 1r4i_d00 naa= 3 ULMN 4 1v15_d00 HYDROLASE user 1 4 # 1 D 5 ARG A 163 ARG~? 6.61 O2 FMT A 175 D 51 ASP A 166 ASP~? 5.39 O2 FMT A 176 D 54 ARG A 101 ARG~? 6.72 O2 FMT A 176 D 96 ARG A 107 ARG~? -5.14 O2 PEG A 177s coo 26.68 123.37 35.42 27.02 123.02 38.47 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 28.85 117.12 30.52 26.97 118.21 30.78 33.53 -18.89 -15.18 35.30 -18.02 -15.79 coo 27.03 113.91 36.12 26.66 115.85 33.77 39.00 -16.21 -14.42 38.67 -18.83 -12.88 coo 15.69 117.00 39.50 16.92 119.48 40.82 32.48 -6.37 -21.24 35.08 -7.16 -19.82 1v15_d00 source 1v15 HYDROLASE : 1 hits 1v15_d00 naa= 4 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 24 ARG A 65 ARG~? 29.62 O1 FMT A 174 A 32 LYS A 66 LYS~? 36.30 O1 FMT A 174 A 46 ARG A 31 ARG~? 22.01 O1 FMT A 174 coo -8.00 4.27 27.74 -7.09 2.66 30.09 47.05 3.71 11.47 47.46 0.69 10.93 coo -5.15 8.65 26.69 -4.26 5.48 32.02 52.34 7.32 12.03 54.08 9.90 7.62 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 48.96 -3.53 -0.04 48.31 -5.49 -2.36 2ky8_d00 source 2ky8 TRANSCRIPTION/DNA : 1 hits 2ky8_d00 naa= 3 ULMN 4 2p0j_d00 HYDROLASE/DNA user 1 4 # 1 A 46 GLU A 145 GLU~? 14.25 C FMT A 174 A 133 LYS A 160 LYS~? 7.79 O1 FMT A 175 A 134 TYR A 161 TYR~? 10.37 O2 FMT A 175 A 172 SER A 155 SER~? 8.21 O2 FMT A 174 coo 29.36 7.53 2.81 27.47 7.30 3.73 12.14 -10.58 -14.19 13.77 -11.35 -13.11 coo 20.43 15.67 9.20 23.49 12.62 10.53 25.45 -16.84 -10.59 23.78 -19.75 -6.08 coo 18.60 12.45 12.36 19.78 10.10 11.41 23.82 -21.26 -14.80 24.13 -23.57 -16.35 coo 23.78 7.59 5.40 26.01 7.14 6.26 19.81 -11.48 -13.97 19.82 -9.22 -13.24 2p0j_d00 source 2p0j HYDROLASE/DNA : 1 hits 2p0j_d00 naa= 4 ULMN 4 2ql2_d00 TRANSCRIPTION/DNA user 1 4 # 1 A 548 ASN A 104 ASN~? -3.09 C4 PEG A 177s A 550 ARG A 163 ARG~? 6.61 O2 FMT A 175 A 551 GLU A 106 GLU~? -4.32 O2 FMT A 174s A 554 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 10.14 52.78 -20.71 8.21 53.68 -20.78 35.06 -12.01 -19.02 34.43 -13.28 -20.72 coo 11.95 46.81 -13.63 11.17 49.52 -12.45 30.03 -15.29 -9.70 32.00 -14.53 -7.50 coo 9.01 46.23 -21.76 8.49 44.22 -21.22 30.43 -7.44 -15.33 30.95 -6.29 -13.59 coo 10.46 41.35 -18.53 9.11 40.22 -21.03 24.40 -10.07 -15.09 26.17 -7.77 -14.09 2ql2_d00 source 2ql2 TRANSCRIPTION/DNA : 1 hits 2ql2_d00 naa= 4 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 78 ARG A 65 ARG~? 29.62 O1 FMT A 174 A 82 LYS A 58 LYS~? 34.16 O1 FMT A 174 A 97 ARG A 67 ARG~? 43.16 O1 FMT A 174 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 47.05 3.71 11.47 47.46 0.69 10.93 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 46.48 -1.26 18.71 47.01 -6.34 18.98 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 57.57 5.82 16.12 60.39 6.14 14.88 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 78 ARG A 111 ARG~? -4.31 O1 PEG A 177s A 82 LYS A 122 LYS~? 10.14 O4 PEG A 177 A 97 ARG A 109 ARG~? -3.22 O2 FMT A 174s coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 27.44 -10.86 -26.00 28.74 -11.94 -28.55 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 24.40 -10.07 -15.09 26.17 -7.77 -14.09 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 A 78 ARG A 148 ARG~? 25.49 O2 FMT A 174 A 82 LYS A 150 LYS~? 21.36 C FMT A 174 A 97 ARG A 140 ARG~? -21.39 O1 PEG A 177s coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 4.94 -7.15 -18.11 3.07 -9.61 -17.80 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 10.40 -5.89 -12.34 6.45 -10.45 -13.59 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 10.76 -17.91 -21.91 12.11 -20.58 -22.47 4er8_d00 source 4er8 DNA BINDING PROTEIN/DNA : 3 hits 4er8_d00 naa= 3 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 1 3 # 1 B 442 LYS A 122 LYS~? 10.14 O4 PEG A 177 B 443 VAL A 124 VAL~? 11.64 O4 PEG A 177 B 447 ARG A 132 ARG~? 15.71 O4 PEG A 177 coo -11.49 8.72 29.13 -11.20 3.78 25.16 28.30 -17.74 -28.93 30.33 -16.15 -33.80 coo -11.96 6.22 31.96 -10.74 4.61 32.81 27.74 -21.97 -25.35 25.89 -23.13 -25.42 coo -14.58 4.58 36.41 -12.11 2.82 36.84 21.56 -24.77 -26.82 24.40 -25.49 -27.78 4hn5_d00 source 4hn5 TRANSCRIPTION/DNA : 1 hits 4hn5_d00 naa= 3 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 C 61 LYS A 157 LYS~? 15.32 C FMT A 174 C 90 HIS A 144 HIS~? 21.24 O2 FMT A 174 C 91 GLN A 143 GLN~? 14.76 O1 PEG A 177 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 20.67 -15.87 -11.19 14.43 -16.61 -10.33 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 8.54 -11.33 -18.05 6.75 -10.98 -17.01 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 15.66 -11.37 -22.27 15.86 -12.22 -24.28 4hp3_d00 source 4hp3 DNA BINDING PROTEIN/DNA : 1 hits 4hp3_d00 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 100 GLU~? 11.75 C4 PEG A 177 A 44 ASP A 92 ASP~? 21.45 O1 FMT A 174 A 50 THR A 95 THR~? 16.24 O1 FMT A 174 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 41.90 -9.49 -16.18 43.86 -10.09 -17.17 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 48.45 -7.46 -6.99 48.53 -6.77 -4.97 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 43.34 -10.82 -8.09 43.52 -9.43 -6.38 3hde_o00 source 3HDE LYSOZYME : 1 hits 3hde_o00 naa= 3 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 1 3 # 1 A 966 SER A 94 SER~? 15.65 O2 FMT A 175 A 967 ARG A 96 ARG~? 20.74 C4 PEG A 177 A 975 TYR A 98 TYR~? 10.02 O2 FMT A 175 coo 82.02 40.88 31.11 79.88 41.56 30.18 45.82 -13.49 -9.13 45.45 -14.29 -6.96 coo 78.94 44.79 33.75 77.86 47.56 32.82 46.88 -7.05 -12.28 49.48 -7.02 -10.60 coo 83.57 40.86 25.45 83.15 43.18 26.91 38.55 -12.80 -8.86 35.99 -13.04 -7.80 4dqk_o00 source 4DQK BIFUNCTIONAL P-450/NADPH-P450 REDUCTASE : 1 hits 4dqk_o00 naa= 3