*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 48 ARG^? 19.83 O1 SO4 A 2 265 HIS A 29 HIS.? 8.77 O4 SO4 A 2 274 TYR A 134 TYR^? 12.54 O1 SO4 A 2 coo -15.18 55.46 8.55 -14.82 52.98 10.38 29.77 32.97 -3.15 29.81 31.97 -6.03 coo -14.48 45.59 11.18 -14.02 47.49 10.42 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 0.94 52.26 9.16 1.95 54.78 9.91 19.31 44.52 -8.45 19.63 41.79 -8.09 1a41_c01 source 1a41 TOPOISOMERASE I : 1 hits 1a41_c01 naa= 3 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 1 3 # 1 33 ASP A 84 ASP^? 13.05 O2 SO4 A 1 187 GLU A 90 GLU.? 11.74 O4 SO4 A 1 229 LYS A 88 LYS.? 16.13 O4 SO4 A 1 coo -52.57 56.60 47.75 -51.52 54.87 46.95 23.67 51.39 11.69 23.63 52.86 10.15 coo -45.08 48.37 46.81 -46.53 49.74 45.96 24.73 45.99 21.49 22.88 45.31 22.33 coo -47.40 44.36 48.48 -50.80 49.18 46.20 23.95 50.46 23.69 18.95 48.60 24.87 1ald_c00 source 1ald ALDOLASE A (E.C.4.1.2.13) : 1 hits 1ald_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 69 ARG.? -8.24 O4 SO4 A 1s A 342 ASP A 84 ASP^? 13.05 O2 SO4 A 1 A 531 ARG A 72 ARG^? 6.20 O1 SO4 A 1 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 28.95 44.37 23.81 27.57 47.11 23.80 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 23.67 51.39 11.69 23.63 52.86 10.15 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 37.15 44.99 14.21 40.05 45.65 13.45 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 1 hits 1asy_c01 naa= 3 ULMN 3 1bol_c00 RIBONUCLEASE RH user 1 3 # 1 A 46 HIS A 29 HIS.? 8.77 O4 SO4 A 2 A 105 GLU A 154 GLU.? 4.17 O1 SO4 A 2 A 109 HIS A 155 HIS.? -3.96 O4 SO4 A 2s coo 40.56 28.26 -3.97 41.87 29.52 -4.90 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 43.60 31.12 0.44 42.42 31.86 -1.18 11.52 31.03 -4.67 10.91 31.46 -6.65 coo 40.53 36.41 -0.12 40.86 36.31 -2.14 14.13 36.22 -2.53 14.16 36.49 -4.61 ULMN 3 1bol_c00 RIBONUCLEASE RH user 2 3 # 2 A 46 HIS A 155 HIS.? -3.96 O4 SO4 A 2s A 105 GLU A 154 GLU.? 4.17 O1 SO4 A 2 A 109 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo 40.56 28.26 -3.97 41.87 29.52 -4.90 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 43.60 31.12 0.44 42.42 31.86 -1.18 11.52 31.03 -4.67 10.91 31.46 -6.65 coo 40.53 36.41 -0.12 40.86 36.31 -2.14 18.68 30.85 -1.97 16.88 29.79 -2.23 1bol_c00 source 1bol RIBONUCLEASE RH : 2 hits 1bol_c00 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 39 GLN.? 21.69 O3 SO4 A 1 C1091 LEU A 120 LEU.? 13.31 O2 SO4 A 1 C1133 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo 68.29 34.44 43.03 66.67 34.74 44.37 25.92 28.71 20.28 24.54 27.49 21.36 coo 65.83 38.95 47.05 65.46 38.90 49.20 27.76 34.45 17.38 28.35 34.73 15.29 coo 63.14 29.39 46.25 63.84 31.31 45.74 20.35 25.30 19.19 19.42 26.30 20.81 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 1 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 39 GLN.? 21.69 O3 SO4 A 1 A 91 LEU A 120 LEU.? 13.31 O2 SO4 A 1 A 133 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo 38.23 53.34 67.59 38.84 53.87 69.56 25.92 28.71 20.28 24.54 27.49 21.36 coo 35.40 53.22 73.30 35.37 54.87 74.74 27.76 34.45 17.38 28.35 34.73 15.29 coo 45.08 56.04 70.60 43.15 55.19 70.77 20.35 25.30 19.19 19.42 26.30 20.81 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 1 hits 1bsj_c00 naa= 3 ULMN 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 A 232 HIS A 29 HIS.? 8.77 O4 SO4 A 2 A 262 GLU A 154 GLU.? 4.17 O1 SO4 A 2 A 358 GLU A 152 GLU.? 7.49 O2 SNN A 149 coo 26.19 60.87 43.98 27.48 59.27 43.30 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 27.13 54.07 50.45 26.96 54.19 48.35 11.52 31.03 -4.67 10.91 31.46 -6.65 coo 27.06 50.43 44.36 27.99 52.27 44.74 11.83 25.40 -1.80 13.15 24.06 -0.90 1chm_c00 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 1 hits 1chm_c00 naa= 3 ULMN 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 B 232 HIS A 29 HIS.? 8.77 O4 SO4 A 2 B 262 GLU A 154 GLU.? 4.17 O1 SO4 A 2 B 358 GLU A 152 GLU.? 7.49 O2 SNN A 149 coo 44.98 77.01 48.39 44.42 78.67 47.18 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 41.60 83.57 54.16 42.46 83.24 52.25 11.52 31.03 -4.67 10.91 31.46 -6.65 coo 44.05 87.61 48.73 43.15 85.67 48.52 11.83 25.40 -1.80 13.15 24.06 -0.90 1chm_c01 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 1 hits 1chm_c01 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU A 154 GLU.? 4.17 O1 SO4 A 2 A 89 GLU A 52 GLU.? 9.01 O1 SO4 A 2 A 120 SER A 27 SER.? 13.12 O4 SO4 A 2 coo -24.35 9.53 67.64 -25.07 11.29 68.60 11.52 31.03 -4.67 10.91 31.46 -6.65 coo -31.18 6.91 75.60 -32.39 8.51 74.91 19.92 35.92 -8.58 19.02 34.66 -7.12 coo -34.73 8.57 68.21 -33.63 9.08 70.28 23.59 29.28 -4.99 22.38 29.64 -2.91 1cns_c00 source 1cns CHITINASE : 1 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 154 GLU.? 4.17 O1 SO4 A 2 B 89 GLU A 52 GLU.? 9.01 O1 SO4 A 2 B 120 SER A 27 SER.? 13.12 O4 SO4 A 2 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 11.52 31.03 -4.67 10.91 31.46 -6.65 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 19.92 35.92 -8.58 19.02 34.66 -7.12 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 23.59 29.28 -4.99 22.38 29.64 -2.91 1cns_c01 source 1cns CHITINASE : 1 hits 1cns_c01 naa= 3 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 # 1 A 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 A 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s A 75 GLY A 78 GLY.? 10.44 C2 DMS A 178 coo -1.80 62.71 122.76 -1.88 63.70 123.92 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 1.20 66.40 122.20 2.03 64.53 121.46 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 4.68 65.84 125.52 4.11 65.60 126.05 35.29 50.61 -4.82 35.23 50.40 -4.05 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 # 2 A 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 A 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s A 75 GLY A 101 GLY.? -3.71 O DMS A 178s coo -1.80 62.71 122.76 -1.88 63.70 123.92 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 1.20 66.40 122.20 2.03 64.53 121.46 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 4.68 65.84 125.52 4.11 65.60 126.05 31.87 55.03 -11.11 31.49 54.53 -10.61 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 3 3 # 3 A 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 A 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s A 75 GLY A 104 GLY.? 6.95 C2 DMS A 178 coo -1.80 62.71 122.76 -1.88 63.70 123.92 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 1.20 66.40 122.20 2.03 64.53 121.46 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 4.68 65.84 125.52 4.11 65.60 126.05 28.53 47.20 -9.10 28.89 47.01 -9.81 1ct9_c04 source 1ct9 ASPARAGINE SYNTHETASE B : 3 hits 1ct9_c04 naa= 3 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 # 1 B 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 B 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s B 75 GLY A 78 GLY.? 10.44 C2 DMS A 178 coo 39.21 14.97 27.55 40.19 16.01 27.08 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 43.06 12.94 25.74 42.26 11.81 27.44 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 46.38 13.54 29.18 46.14 14.29 29.26 35.29 50.61 -4.82 35.23 50.40 -4.05 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 # 2 B 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 B 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s B 75 GLY A 101 GLY.? -3.71 O DMS A 178s coo 39.21 14.97 27.55 40.19 16.01 27.08 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 43.06 12.94 25.74 42.26 11.81 27.44 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 46.38 13.54 29.18 46.14 14.29 29.26 31.87 55.03 -11.11 31.49 54.53 -10.61 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 3 3 # 3 B 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 B 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s B 75 GLY A 104 GLY.? 6.95 C2 DMS A 178 coo 39.21 14.97 27.55 40.19 16.01 27.08 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 43.06 12.94 25.74 42.26 11.81 27.44 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 46.38 13.54 29.18 46.14 14.29 29.26 28.53 47.20 -9.10 28.89 47.01 -9.81 1ct9_c05 source 1ct9 ASPARAGINE SYNTHETASE B : 3 hits 1ct9_c05 naa= 3 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 # 1 C 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 C 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s C 75 GLY A 78 GLY.? 10.44 C2 DMS A 178 coo 16.14 15.08 36.63 15.28 14.65 37.81 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 11.60 16.13 36.70 12.80 17.74 35.96 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 10.99 19.23 40.32 11.50 18.77 40.74 35.29 50.61 -4.82 35.23 50.40 -4.05 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 2 3 # 2 C 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 C 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s C 75 GLY A 101 GLY.? -3.71 O DMS A 178s coo 16.14 15.08 36.63 15.28 14.65 37.81 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 11.60 16.13 36.70 12.80 17.74 35.96 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 10.99 19.23 40.32 11.50 18.77 40.74 31.87 55.03 -11.11 31.49 54.53 -10.61 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 3 3 # 3 C 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 C 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s C 75 GLY A 104 GLY.? 6.95 C2 DMS A 178 coo 16.14 15.08 36.63 15.28 14.65 37.81 29.29 50.81 -4.54 28.71 50.16 -5.81 coo 11.60 16.13 36.70 12.80 17.74 35.96 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 10.99 19.23 40.32 11.50 18.77 40.74 28.53 47.20 -9.10 28.89 47.01 -9.81 1ct9_c06 source 1ct9 ASPARAGINE SYNTHETASE B : 3 hits 1ct9_c06 naa= 3 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 # 1 D 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 D 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s D 75 GLY A 78 GLY.? 10.44 C2 DMS A 178 coo -13.31 41.90 116.45 -13.05 40.39 116.25 29.29 50.81 -4.54 28.71 50.16 -5.81 coo -16.85 39.36 115.26 -17.55 40.58 116.90 32.14 51.09 -8.35 32.20 49.00 -7.97 coo -17.65 36.37 119.00 -16.85 36.22 119.00 35.29 50.61 -4.82 35.23 50.40 -4.05 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 2 3 # 2 D 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 D 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s D 75 GLY A 101 GLY.? -3.71 O DMS A 178s coo -13.31 41.90 116.45 -13.05 40.39 116.25 29.29 50.81 -4.54 28.71 50.16 -5.81 coo -16.85 39.36 115.26 -17.55 40.58 116.90 32.14 51.09 -8.35 32.20 49.00 -7.97 coo -17.65 36.37 119.00 -16.85 36.22 119.00 31.87 55.03 -11.11 31.49 54.53 -10.61 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 3 3 # 3 D 1 ALA A 98 ALA^? 7.24 C2 DMS A 178 D 74 ASN A 102 ASN.? -7.15 C2 DMS A 178s D 75 GLY A 104 GLY.? 6.95 C2 DMS A 178 coo -13.31 41.90 116.45 -13.05 40.39 116.25 29.29 50.81 -4.54 28.71 50.16 -5.81 coo -16.85 39.36 115.26 -17.55 40.58 116.90 32.14 51.09 -8.35 32.20 49.00 -7.97 coo -17.65 36.37 119.00 -16.85 36.22 119.00 28.53 47.20 -9.10 28.89 47.01 -9.81 1ct9_c07 source 1ct9 ASPARAGINE SYNTHETASE B : 3 hits 1ct9_c07 naa= 3 ULMN 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 1 3 # 1 B 41 HIS A 155 HIS.? -3.96 O4 SO4 A 2s B 43 HIS A 29 HIS.? 8.77 O4 SO4 A 2 B 65 GLU A 152 GLU.? 7.49 O2 SNN A 149 coo 20.15 22.08 34.36 20.84 20.10 34.21 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 19.55 18.91 30.27 18.21 18.65 31.84 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 10.90 21.31 28.81 12.14 22.15 30.31 11.83 25.40 -1.80 13.15 24.06 -0.90 1e7l_c01 source 1e7l RECOMBINATION ENDONUCLEASE VII : 1 hits 1e7l_c01 naa= 3 ULMN 3 1esc_c00 ESTERASE user 1 3 # 1 14 SER A 27 SER.? 13.12 O4 SO4 A 2 280 TRP A 142 TRP^? 8.47 O4 SO4 A 2 283 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo 48.81 15.65 -14.70 47.48 13.77 -15.39 23.59 29.28 -4.99 22.38 29.64 -2.91 coo 36.74 18.46 -19.41 39.06 21.05 -17.69 18.61 39.28 -0.56 18.44 35.94 -2.63 coo 43.44 15.25 -16.26 44.71 13.88 -17.22 18.68 30.85 -1.97 16.88 29.79 -2.23 1esc_c00 source 1esc ESTERASE : 1 hits 1esc_c00 naa= 3 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 1 3 # 1 A 197 ARG A 48 ARG^? 19.83 O1 SO4 A 2 A 201 HIS A 155 HIS.? -3.96 O4 SO4 A 2s A 204 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo -27.47 20.45 37.96 -26.70 17.86 36.51 29.77 32.97 -3.15 29.81 31.97 -6.03 coo -15.08 14.90 41.58 -16.70 13.64 42.02 14.13 36.22 -2.53 14.16 36.49 -4.61 coo -15.44 20.23 39.72 -16.43 18.87 38.47 18.68 30.85 -1.97 16.88 29.79 -2.23 1g8f_c00 source 1g8f SULFATE ADENYLYLTRANSFERASE : 1 hits 1g8f_c00 naa= 3 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 1 3 # 1 A 314 TRP A 142 TRP^? 8.47 O4 SO4 A 2 A 317 GLU A 131 GLU^? 11.19 O4 SO4 A 2 A 365 ARG A 138 ARG.? 11.04 O1 SO4 A 2 coo 79.91 26.87 38.77 78.95 23.18 37.81 18.61 39.28 -0.56 18.44 35.94 -2.63 coo 85.55 26.30 41.25 85.59 24.97 39.65 16.73 44.79 3.18 14.87 44.10 2.44 coo 83.47 25.30 27.10 83.44 27.82 25.29 13.38 45.25 -10.19 15.76 43.26 -10.33 1g8o_c01 source 1g8o N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALACTOSYLTRA: 1 hits 1g8o_c01 naa= 3 ULMN 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 1 3 # 1 412 GLU A 52 GLU.? 9.01 O1 SO4 A 2 516 HIS A 29 HIS.? 8.77 O4 SO4 A 2 559 HIS A 155 HIS.? -3.96 O4 SO4 A 2s coo 49.01 14.50 52.53 46.99 14.61 52.78 19.92 35.92 -8.58 19.02 34.66 -7.12 coo 41.59 7.83 54.15 41.16 9.87 53.87 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 42.22 14.55 52.50 43.91 14.87 53.60 14.13 36.22 -2.53 14.16 36.49 -4.61 ULMN 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 2 3 # 2 412 GLU A 52 GLU.? 9.01 O1 SO4 A 2 516 HIS A 155 HIS.? -3.96 O4 SO4 A 2s 559 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo 49.01 14.50 52.53 46.99 14.61 52.78 19.92 35.92 -8.58 19.02 34.66 -7.12 coo 41.59 7.83 54.15 41.16 9.87 53.87 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 42.22 14.55 52.50 43.91 14.87 53.60 18.68 30.85 -1.97 16.88 29.79 -2.23 ULMN 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 3 3 # 3 412 GLU A 152 GLU.? 7.49 O2 SNN A 149 516 HIS A 155 HIS.? -3.96 O4 SO4 A 2s 559 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo 49.01 14.50 52.53 46.99 14.61 52.78 11.83 25.40 -1.80 13.15 24.06 -0.90 coo 41.59 7.83 54.15 41.16 9.87 53.87 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 42.22 14.55 52.50 43.91 14.87 53.60 18.68 30.85 -1.97 16.88 29.79 -2.23 1gal_c00 source 1gal GLUCOSE OXIDASE (E.C.1.1.3.4) : 3 hits 1gal_c00 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 115 VAL^? 9.27 O2 SO4 A 1 A 200 ASP A 84 ASP^? 13.05 O2 SO4 A 1 A 226 LYS A 88 LYS.? 16.13 O4 SO4 A 1 coo 19.13 38.05 1.41 19.72 38.80 -0.53 32.18 41.39 8.24 30.22 41.98 9.13 coo 24.51 43.28 11.18 25.17 44.50 9.58 23.67 51.39 11.69 23.63 52.86 10.15 coo 34.47 51.09 7.19 28.58 51.18 7.53 23.95 50.46 23.69 18.95 48.60 24.87 1i29_c03 source 1i29 CSDB : 1 hits 1i29_c03 naa= 3 ULMN 3 1j70_c00 ATP SULPHURYLASE user 1 3 # 1 A 197 ARG A 48 ARG^? 19.83 O1 SO4 A 2 A 201 HIS A 155 HIS.? -3.96 O4 SO4 A 2s A 204 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 29.77 32.97 -3.15 29.81 31.97 -6.03 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 14.13 36.22 -2.53 14.16 36.49 -4.61 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 18.68 30.85 -1.97 16.88 29.79 -2.23 1j70_c00 source 1j70 ATP SULPHURYLASE : 1 hits 1j70_c00 naa= 3 ULMN 3 1j70_c01 ATP SULPHURYLASE user 1 3 # 1 B 197 ARG A 48 ARG^? 19.83 O1 SO4 A 2 B 201 HIS A 155 HIS.? -3.96 O4 SO4 A 2s B 204 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo -18.85 104.93 27.44 -18.03 106.58 29.88 29.77 32.97 -3.15 29.81 31.97 -6.03 coo -8.48 114.03 24.38 -10.47 114.55 23.97 14.13 36.22 -2.53 14.16 36.49 -4.61 coo -6.99 108.94 26.28 -8.54 109.57 27.55 18.68 30.85 -1.97 16.88 29.79 -2.23 1j70_c01 source 1j70 ATP SULPHURYLASE : 1 hits 1j70_c01 naa= 3 ULMN 3 1j70_c02 ATP SULPHURYLASE user 1 3 # 1 C 197 ARG A 48 ARG^? 19.83 O1 SO4 A 2 C 201 HIS A 155 HIS.? -3.96 O4 SO4 A 2s C 204 HIS A 29 HIS.? 8.77 O4 SO4 A 2 coo 30.92 14.23 15.70 28.82 13.90 13.48 29.77 32.97 -3.15 29.81 31.97 -6.03 coo 20.16 5.55 18.86 20.00 7.59 19.34 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 24.92 3.29 16.90 24.41 4.92 15.69 18.68 30.85 -1.97 16.88 29.79 -2.23 1j70_c02 source 1j70 ATP SULPHURYLASE : 1 hits 1j70_c02 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 90 GLU.? 11.74 O4 SO4 A 1 A 163 ARG A 69 ARG.? -8.24 O4 SO4 A 1s A 222 ARG A 85 ARG^? -3.54 O2 SO4 A 1s coo 51.27 81.34 48.31 51.67 80.79 50.28 24.73 45.99 21.49 22.88 45.31 22.33 coo 48.06 78.22 50.94 48.51 78.27 53.98 28.95 44.37 23.81 27.57 47.11 23.80 coo 54.85 84.16 52.60 54.26 81.23 53.34 28.11 50.34 16.85 30.45 48.42 16.82 1kim_c00 source 1kim THYMIDINE KINASE : 1 hits 1kim_c00 naa= 3 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 1 3 # 1 A 44 HIS A 155 HIS.? -3.96 O4 SO4 A 2s A 45 HIS A 29 HIS.? 8.77 O4 SO4 A 2 A 261 PHE A 47 PHE^? 15.27 O2 SO4 A 1 coo 49.89 1.93 30.83 50.54 1.43 32.81 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 26.69 38.12 4.39 26.04 38.09 7.10 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 2 3 # 2 A 44 HIS A 155 HIS.? -3.96 O4 SO4 A 2s A 45 HIS A 29 HIS.? 8.77 O4 SO4 A 2 A 261 PHE A 110 PHE^? 17.06 O1 SO4 A 2 coo 49.89 1.93 30.83 50.54 1.43 32.81 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 27.94 34.47 -7.28 26.13 32.55 -8.15 1luc_c00 source 1luc BACTERIAL LUCIFERASE : 2 hits 1luc_c00 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 84 ASP^? 13.05 O2 SO4 A 1 A 279 GLU A 74 GLU.? 13.93 O2 SO4 A 1 A 369 ASP A 87 ASP.? 15.51 O4 SO4 A 1 coo 11.74 38.14 80.19 10.63 36.40 80.65 23.67 51.39 11.69 23.63 52.86 10.15 coo 16.54 46.37 63.94 14.77 45.79 62.95 37.22 42.43 4.54 38.11 40.53 4.53 coo 12.19 31.08 87.29 11.13 32.66 86.38 20.80 53.66 22.83 19.53 51.95 23.11 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 1 hits 1m53_c06 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 69 ARG.? -8.24 O4 SO4 A 1s 229 SER A 89 SER.? 8.54 O4 SO4 A 1 325 GLU A 90 GLU.? 11.74 O4 SO4 A 1 coo 2.54 15.84 18.57 3.24 17.85 16.30 28.95 44.37 23.81 27.57 47.11 23.80 coo 10.17 13.48 15.92 9.61 15.76 15.27 26.71 50.67 21.06 27.81 52.31 22.43 coo 5.42 13.04 19.75 5.74 13.81 17.79 24.73 45.99 21.49 22.88 45.31 22.33 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 1 hits 1mbb_c00 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 27 SER.? 13.12 O4 SO4 A 2 A 154 ASP A 33 ASP.? 20.24 O4 SO4 A 2 A 261 ARG A 48 ARG^? 19.83 O1 SO4 A 2 coo 16.10 74.10 3.11 17.18 73.52 5.20 23.59 29.28 -4.99 22.38 29.64 -2.91 coo 16.07 84.71 8.14 15.20 82.81 8.14 30.51 30.96 4.30 29.31 30.06 2.78 coo 10.59 77.85 4.81 13.09 76.36 5.76 29.77 32.97 -3.15 29.81 31.97 -6.03 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 1 hits 1o98_c00 naa= 3 ULMN 3 1onr_c00 TRANSALDOLASE B user 1 3 # 1 A 17 ASP A 84 ASP^? 13.05 O2 SO4 A 1 A 96 GLU A 90 GLU.? 11.74 O4 SO4 A 1 A 132 LYS A 88 LYS.? 16.13 O4 SO4 A 1 coo 31.23 12.29 16.44 30.82 11.56 18.39 23.67 51.39 11.69 23.63 52.86 10.15 coo 26.82 3.20 24.36 27.99 4.86 24.98 24.73 45.99 21.49 22.88 45.31 22.33 coo 29.99 0.62 22.18 30.38 6.69 20.81 23.95 50.46 23.69 18.95 48.60 24.87 1onr_c00 source 1onr TRANSALDOLASE B : 1 hits 1onr_c00 naa= 3 ULMN 3 1onr_c01 TRANSALDOLASE B user 1 3 # 1 B 17 ASP A 84 ASP^? 13.05 O2 SO4 A 1 B 96 GLU A 90 GLU.? 11.74 O4 SO4 A 1 B 132 LYS A 88 LYS.? 16.13 O4 SO4 A 1 coo 31.16 57.31 -0.94 30.73 56.64 1.01 23.67 51.39 11.69 23.63 52.86 10.15 coo 26.69 48.45 7.18 27.85 50.13 7.74 24.73 45.99 21.49 22.88 45.31 22.33 coo 29.82 45.80 5.07 30.26 51.81 3.56 23.95 50.46 23.69 18.95 48.60 24.87 1onr_c01 source 1onr TRANSALDOLASE B : 1 hits 1onr_c01 naa= 3 ULMN 3 1oqz_c00 GLUTARYL ACYLASE user 1 3 # 1 A 170 SER A 89 SER.? 8.54 O4 SO4 A 1 A 239 VAL A 92 VAL^? 11.61 O2 SO4 A 1 A 413 ASN A 86 ASN.? 11.88 O4 SO4 A 1 coo 80.14 40.76 52.28 77.73 40.59 51.94 26.71 50.67 21.06 27.81 52.31 22.43 coo 75.67 35.37 52.30 76.00 35.96 50.23 22.50 46.53 14.39 21.44 48.28 15.23 coo 81.75 35.21 52.13 80.92 37.12 51.69 21.13 50.35 19.09 21.99 48.83 20.31 1oqz_c00 source 1oqz GLUTARYL ACYLASE : 1 hits 1oqz_c00 naa= 3 ULMN 3 1oqz_c01 GLUTARYL ACYLASE user 1 3 # 1 B 170 SER A 89 SER.? 8.54 O4 SO4 A 1 B 239 VAL A 92 VAL^? 11.61 O2 SO4 A 1 B 413 ASN A 86 ASN.? 11.88 O4 SO4 A 1 coo 25.22 6.41 2.90 27.67 6.33 3.11 26.71 50.67 21.06 27.81 52.31 22.43 coo 29.71 1.00 2.66 29.43 1.57 4.74 22.50 46.53 14.39 21.44 48.28 15.23 coo 23.72 0.88 2.95 24.56 2.79 3.34 21.13 50.35 19.09 21.99 48.83 20.31 1oqz_c01 source 1oqz GLUTARYL ACYLASE : 1 hits 1oqz_c01 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 38 ALA.? 17.60 O3 SO4 A 1 A 126 LEU A 162 LEU.? 18.38 O2 SO4 A 1 A 158 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo -2.29 37.66 144.73 -1.46 37.12 145.87 30.30 29.23 17.73 31.50 28.80 18.56 coo -4.62 32.83 147.14 -5.50 32.85 149.12 25.82 29.04 16.70 25.84 31.04 15.89 coo -0.83 29.57 149.77 -0.39 31.47 148.95 20.35 25.30 19.19 19.42 26.30 20.81 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 163 ALA.? 21.82 O3 SO4 A 1 A 126 LEU A 162 LEU.? 18.38 O2 SO4 A 1 A 158 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo -2.29 37.66 144.73 -1.46 37.12 145.87 28.33 25.22 17.58 29.77 24.85 17.22 coo -4.62 32.83 147.14 -5.50 32.85 149.12 25.82 29.04 16.70 25.84 31.04 15.89 coo -0.83 29.57 149.77 -0.39 31.47 148.95 20.35 25.30 19.19 19.42 26.30 20.81 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 38 ALA.? 17.60 O3 SO4 A 1 B 126 LEU A 162 LEU.? 18.38 O2 SO4 A 1 B 158 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo -39.79 4.61 147.27 -39.61 5.56 148.47 30.30 29.23 17.73 31.50 28.80 18.56 coo -34.22 5.06 149.25 -33.65 4.24 151.15 25.82 29.04 16.70 25.84 31.04 15.89 coo -33.03 9.93 151.71 -34.98 9.38 151.11 20.35 25.30 19.19 19.42 26.30 20.81 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 163 ALA.? 21.82 O3 SO4 A 1 B 126 LEU A 162 LEU.? 18.38 O2 SO4 A 1 B 158 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo -39.79 4.61 147.27 -39.61 5.56 148.47 28.33 25.22 17.58 29.77 24.85 17.22 coo -34.22 5.06 149.25 -33.65 4.24 151.15 25.82 29.04 16.70 25.84 31.04 15.89 coo -33.03 9.93 151.71 -34.98 9.38 151.11 20.35 25.30 19.19 19.42 26.30 20.81 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 38 ALA.? 17.60 O3 SO4 A 1 C 126 LEU A 162 LEU.? 18.38 O2 SO4 A 1 C 158 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 30.30 29.23 17.73 31.50 28.80 18.56 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 25.82 29.04 16.70 25.84 31.04 15.89 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 20.35 25.30 19.19 19.42 26.30 20.81 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 163 ALA.? 21.82 O3 SO4 A 1 C 126 LEU A 162 LEU.? 18.38 O2 SO4 A 1 C 158 GLU A 124 GLU.? 18.68 N3 SNN A 149 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 28.33 25.22 17.58 29.77 24.85 17.22 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 25.82 29.04 16.70 25.84 31.04 15.89 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 20.35 25.30 19.19 19.42 26.30 20.81 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c02 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN A 111 GLN^? 14.54 C2 DMS A 178 294 GLU A 74 GLU.? 13.93 O2 SO4 A 1 304 ARG A 48 ARG^? 19.83 O1 SO4 A 2 coo 15.89 18.45 46.53 15.82 16.91 48.02 30.72 41.57 -3.96 32.72 41.78 -4.57 coo 22.84 13.44 52.91 20.84 13.18 52.38 37.22 42.43 4.54 38.11 40.53 4.53 coo 8.71 17.11 46.51 7.23 17.64 49.20 29.77 32.97 -3.15 29.81 31.97 -6.03 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 1 hits 1pmi_c00 naa= 3 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 # 1 B 1 SER A 89 SER.? 8.54 O4 SO4 A 1 B 69 ALA A 91 ALA^? 6.39 O2 SO4 A 1 B 241 ASN A 86 ASN.? 11.88 O4 SO4 A 1 coo 13.24 41.94 33.13 13.08 39.54 33.17 26.71 50.67 21.06 27.81 52.31 22.43 coo 9.15 37.89 36.69 10.55 37.76 37.22 26.05 46.94 15.79 27.21 46.24 15.08 coo 10.91 43.03 38.47 11.81 41.82 36.93 21.13 50.35 19.09 21.99 48.83 20.31 1pnl_c00 source 1pnl PENICILLIN AMIDOHYDROLASE : 1 hits 1pnl_c00 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 33 ASP.? 20.24 O4 SO4 A 2 A 68 ALA A 32 ALA^? 17.55 O4 SO4 A 2 A 72 LEU A 160 LEU^? 17.90 O2 SO4 A 1 coo 46.76 7.59 18.65 45.27 6.01 18.52 30.51 30.96 4.30 29.31 30.06 2.78 coo 48.88 4.35 16.59 48.73 5.09 15.20 26.47 33.11 4.80 25.64 33.43 6.03 coo 53.89 6.25 15.09 52.88 7.92 14.14 25.35 30.97 10.99 27.03 31.82 10.00 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 33 ASP.? 20.24 O4 SO4 A 2 A 68 ALA A 34 ALA.? 16.13 O2 SO4 A 1 A 72 LEU A 160 LEU^? 17.90 O2 SO4 A 1 coo 46.76 7.59 18.65 45.27 6.01 18.52 30.51 30.96 4.30 29.31 30.06 2.78 coo 48.88 4.35 16.59 48.73 5.09 15.20 31.71 31.25 8.76 30.99 32.16 9.70 coo 53.89 6.25 15.09 52.88 7.92 14.14 25.35 30.97 10.99 27.03 31.82 10.00 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 2 hits 1q6l_c05 naa= 3 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 183 GLY A 40 GLY.? 14.55 O3 SO4 A 1 B 419 GLY A 41 GLY.? 13.09 O3 SO4 A 1 B 420 ALA A 38 ALA.? 17.60 O3 SO4 A 1 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 29.36 33.45 22.11 29.59 33.13 21.41 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 32.12 33.41 19.51 31.51 33.96 19.39 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 30.30 29.23 17.73 31.50 28.80 18.56 1xny_c00 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 1 hits 1xny_c00 naa= 3 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 420 ALA A 37 ALA.? 17.11 O2 SO4 A 1 B 182 GLY A 40 GLY.? 14.55 O3 SO4 A 1 B 183 GLY A 41 GLY.? 13.09 O3 SO4 A 1 coo 38.36-101.47-135.52 39.62-101.29-136.35 31.08 30.10 14.13 29.92 30.27 13.15 coo 41.93-102.35-126.87 41.52-101.89-126.30 29.36 33.45 22.11 29.59 33.13 21.41 coo 38.37-101.99-128.11 38.63-102.24-127.37 32.12 33.41 19.51 31.51 33.96 19.39 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 420 ALA A 123 ALA.? 20.16 N3 SNN A 149 B 182 GLY A 41 GLY.? 13.09 O3 SO4 A 1 B 183 GLY A 40 GLY.? 14.55 O3 SO4 A 1 coo 38.36-101.47-135.52 39.62-101.29-136.35 21.39 30.29 20.23 20.57 31.33 19.48 coo 41.93-102.35-126.87 41.52-101.89-126.30 32.12 33.41 19.51 31.51 33.96 19.39 coo 38.37-101.99-128.11 38.63-102.24-127.37 29.36 33.45 22.11 29.59 33.13 21.41 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 # 3 A 420 ALA A 163 ALA.? 21.82 O3 SO4 A 1 B 182 GLY A 40 GLY.? 14.55 O3 SO4 A 1 B 183 GLY A 41 GLY.? 13.09 O3 SO4 A 1 coo 38.36-101.47-135.52 39.62-101.29-136.35 28.33 25.22 17.58 29.77 24.85 17.22 coo 41.93-102.35-126.87 41.52-101.89-126.30 29.36 33.45 22.11 29.59 33.13 21.41 coo 38.37-101.99-128.11 38.63-102.24-127.37 32.12 33.41 19.51 31.51 33.96 19.39 1xny_c01 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 3 hits 1xny_c01 naa= 3 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s B 50 GLU A 131 GLU^? 11.19 O4 SO4 A 2 B 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 37.74 -17.01 11.59 38.11 -17.83 13.49 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 16.73 44.79 3.18 14.87 44.10 2.44 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.96 35.18 2.33 10.53 34.52 0.34 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s B 50 GLU A 152 GLU.? 7.49 O2 SNN A 149 B 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 37.74 -17.01 11.59 38.11 -17.83 13.49 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 11.83 25.40 -1.80 13.15 24.06 -0.90 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.96 35.18 2.33 10.53 34.52 0.34 2ag0_c04 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c04 naa= 3 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s B 50 GLU A 131 GLU^? 11.19 O4 SO4 A 2 B 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 37.74 -17.01 11.59 38.11 -17.83 13.49 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 16.73 44.79 3.18 14.87 44.10 2.44 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.96 35.18 2.33 10.53 34.52 0.34 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s B 50 GLU A 152 GLU.? 7.49 O2 SNN A 149 B 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 37.74 -17.01 11.59 38.11 -17.83 13.49 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 11.83 25.40 -1.80 13.15 24.06 -0.90 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 10.96 35.18 2.33 10.53 34.52 0.34 2ag0_c08 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c08 naa= 3 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 1 3 # 1 A 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s A 50 GLU A 131 GLU^? 11.19 O4 SO4 A 2 A 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 73.37 -13.43 4.64 73.06 -11.77 3.39 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 16.73 44.79 3.18 14.87 44.10 2.44 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 10.96 35.18 2.33 10.53 34.52 0.34 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 2 3 # 2 A 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s A 50 GLU A 152 GLU.? 7.49 O2 SNN A 149 A 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 73.37 -13.43 4.64 73.06 -11.77 3.39 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 11.83 25.40 -1.80 13.15 24.06 -0.90 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 10.96 35.18 2.33 10.53 34.52 0.34 2ag0_c09 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c09 naa= 3 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 1 3 # 1 C 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s C 50 GLU A 131 GLU^? 11.19 O4 SO4 A 2 C 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 74.92 8.52 28.42 74.88 6.86 29.70 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 65.25 15.95 28.73 65.73 15.63 30.78 16.73 44.79 3.18 14.87 44.10 2.44 coo 70.80 6.73 32.72 71.88 8.55 32.53 10.96 35.18 2.33 10.53 34.52 0.34 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 2 3 # 2 C 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s C 50 GLU A 152 GLU.? 7.49 O2 SNN A 149 C 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 74.92 8.52 28.42 74.88 6.86 29.70 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 65.25 15.95 28.73 65.73 15.63 30.78 11.83 25.40 -1.80 13.15 24.06 -0.90 coo 70.80 6.73 32.72 71.88 8.55 32.53 10.96 35.18 2.33 10.53 34.52 0.34 2ag0_c10 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c10 naa= 3 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 1 3 # 1 D 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s D 50 GLU A 131 GLU^? 11.19 O4 SO4 A 2 D 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 38.66 11.31 27.15 38.67 12.13 25.22 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 48.72 12.85 33.83 48.36 14.77 32.95 16.73 44.79 3.18 14.87 44.10 2.44 coo 42.85 14.77 24.15 41.85 15.11 26.02 10.96 35.18 2.33 10.53 34.52 0.34 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 2 3 # 2 D 29 HIS A 155 HIS.? -3.96 O4 SO4 A 2s D 50 GLU A 152 GLU.? 7.49 O2 SNN A 149 D 113 GLN A 144 GLN.? -3.05 O4 SO4 A 2s coo 38.66 11.31 27.15 38.67 12.13 25.22 14.13 36.22 -2.53 14.16 36.49 -4.61 coo 48.72 12.85 33.83 48.36 14.77 32.95 11.83 25.40 -1.80 13.15 24.06 -0.90 coo 42.85 14.77 24.15 41.85 15.11 26.02 10.96 35.18 2.33 10.53 34.52 0.34 2ag0_c11 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c11 naa= 3 ULMN 3 2dbt_c00 CHITINASE C user 1 3 # 1 A 147 GLU A 154 GLU.? 4.17 O1 SO4 A 2 A 156 GLU A 52 GLU.? 9.01 O1 SO4 A 2 A 194 ASN A 143 ASN.? 8.22 O4 SO4 A 2 coo 74.14 15.91 8.55 72.08 15.36 8.63 11.52 31.03 -4.67 10.91 31.46 -6.65 coo 67.47 20.07 1.34 65.99 20.06 2.88 19.92 35.92 -8.58 19.02 34.66 -7.12 coo 67.44 25.26 13.91 67.54 23.65 15.28 13.52 39.35 5.12 11.78 39.81 4.01 2dbt_c00 source 2dbt CHITINASE C : 1 hits 2dbt_c00 naa= 3 ULMN 3 2dbt_c02 CHITINASE C user 1 3 # 1 C 147 GLU A 154 GLU.? 4.17 O1 SO4 A 2 C 156 GLU A 52 GLU.? 9.01 O1 SO4 A 2 C 194 ASN A 143 ASN.? 8.22 O4 SO4 A 2 coo 41.23 29.31 13.28 43.03 29.85 12.29 11.52 31.03 -4.67 10.91 31.46 -6.65 coo 44.75 23.09 5.51 46.77 22.91 6.12 19.92 35.92 -8.58 19.02 34.66 -7.12 coo 49.75 21.00 18.12 50.45 23.02 18.26 13.52 39.35 5.12 11.78 39.81 4.01 2dbt_c02 source 2dbt CHITINASE C : 1 hits 2dbt_c02 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 33 ASP.? 20.24 O4 SO4 A 2 166 GLY A 108 GLY.? 17.14 C2 DMS A 178 169 GLU A 54 GLU.? 16.10 O1 SO4 A 2 coo 8.28 6.87 1.62 10.08 5.77 1.34 30.51 30.96 4.30 29.31 30.06 2.78 coo -8.58 13.22 3.21 -8.90 13.15 4.05 25.44 36.55 -13.46 25.73 37.11 -12.98 coo -16.67 7.89 2.78 -17.65 6.56 1.49 18.82 37.76 -17.52 17.91 36.81 -19.14 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 1 hits 2tdt_c00 naa= 3 ULMN 3 5fit_c00 FRAGILE HISTIDINE TRIAD PROTEIN user 1 3 # 1 83 GLN A 132 GLN^? 11.99 O1 SO4 A 2 94 HIS A 29 HIS.? 8.77 O4 SO4 A 2 96 HIS A 155 HIS.? -3.96 O4 SO4 A 2s coo 12.06 13.83 19.61 9.96 13.82 20.00 21.10 42.47 -3.81 21.03 40.56 -4.82 coo 15.69 26.32 19.80 17.39 27.17 20.68 18.68 30.85 -1.97 16.88 29.79 -2.23 coo 14.38 20.59 22.16 12.49 20.21 21.35 14.13 36.22 -2.53 14.16 36.49 -4.61 5fit_c00 source 5fit FRAGILE HISTIDINE TRIAD PROTEIN : 1 hits 5fit_c00 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 67 ASN^? 13.70 O2 SO4 A 1 coo 5.80 63.03 55.85 5.52 65.03 56.45 21.88 43.38 18.89 20.15 44.35 18.08 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 86 ASN.? 11.88 O4 SO4 A 1 coo 5.80 63.03 55.85 5.52 65.03 56.45 21.13 50.35 19.09 21.99 48.83 20.31 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 102 ASN.? -7.15 C2 DMS A 178s coo 5.80 63.03 55.85 5.52 65.03 56.45 32.14 51.09 -8.35 32.20 49.00 -7.97 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 143 ASN.? 8.22 O4 SO4 A 2 coo 5.80 63.03 55.85 5.52 65.03 56.45 13.52 39.35 5.12 11.78 39.81 4.01 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 69 ARG.? -8.24 O4 SO4 A 1s A 188 TYR A 42 TYR.? 7.48 O3 SO4 A 1 A 190 SER A 70 SER^? -2.62 O3 SO4 A 1s coo 37.69 7.64 13.51 38.82 8.84 16.11 28.95 44.37 23.81 27.57 47.11 23.80 coo 47.14 12.10 13.73 48.75 12.33 16.01 34.69 37.67 18.30 34.25 39.71 19.91 coo 43.77 6.93 15.46 45.49 7.21 17.11 31.92 44.17 17.73 34.19 43.63 17.15 ULMN 3 2p3i_p00 VP4 user 2 3 # 2 A 101 ARG A 72 ARG^? 6.20 O1 SO4 A 1 A 188 TYR A 42 TYR.? 7.48 O3 SO4 A 1 A 190 SER A 70 SER^? -2.62 O3 SO4 A 1s coo 37.69 7.64 13.51 38.82 8.84 16.11 37.15 44.99 14.21 40.05 45.65 13.45 coo 47.14 12.10 13.73 48.75 12.33 16.01 34.69 37.67 18.30 34.25 39.71 19.91 coo 43.77 6.93 15.46 45.49 7.21 17.11 31.92 44.17 17.73 34.19 43.63 17.15 ULMN 3 2p3i_p00 VP4 user 3 3 # 3 A 101 ARG A 72 ARG^? 6.20 O1 SO4 A 1 A 188 TYR A 42 TYR.? 7.48 O3 SO4 A 1 A 190 SER A 116 SER^? 9.01 O2 SO4 A 1 coo 37.69 7.64 13.51 38.82 8.84 16.11 37.15 44.99 14.21 40.05 45.65 13.45 coo 47.14 12.10 13.73 48.75 12.33 16.01 34.69 37.67 18.30 34.25 39.71 19.91 coo 43.77 6.93 15.46 45.49 7.21 17.11 33.87 40.25 11.45 36.10 40.15 10.56 2p3i_p00 source 2p3i VP4 : 3 hits 2p3i_p00 naa= 3 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 # 1 A 270 ASN A 102 ASN.? -7.15 C2 DMS A 178s A 384 ASN A 143 ASN.? 8.22 O4 SO4 A 2 A 385 GLU A 131 GLU^? 11.19 O4 SO4 A 2 coo 22.28 63.17 110.61 22.47 65.06 111.53 32.14 51.09 -8.35 32.20 49.00 -7.97 coo 7.06 50.07 96.17 8.50 48.54 96.31 13.52 39.35 5.12 11.78 39.81 4.01 coo 11.59 49.83 99.41 10.92 47.97 100.16 16.73 44.79 3.18 14.87 44.10 2.44 2v3r_p00 source 2v3r EXOGLUCANASE 1 : 1 hits 2v3r_p00 naa= 3 ULMN 3 1b01_d00 GENE REGULATION/DNA user 1 3 # 1 B 4 ARG A 48 ARG^? 19.83 O1 SO4 A 2 B 6 THR A 31 THR^? 15.90 O4 SO4 A 2 B 8 THR A 159 THR^? 14.53 N3 SNN A 149 coo 40.52 16.08 100.90 37.97 16.41 102.60 29.77 32.97 -3.15 29.81 31.97 -6.03 coo 36.11 13.64 95.03 34.54 14.86 95.91 24.73 32.58 1.48 25.67 31.31 0.03 coo 32.72 8.05 92.39 31.25 9.11 91.35 21.41 31.69 8.36 19.46 31.00 9.14 ULMN 3 1b01_d00 GENE REGULATION/DNA user 2 3 # 2 B 4 ARG A 82 ARG^? -14.39 O2 SO4 A 1s B 6 THR A 62 THR^? 16.82 O2 SO4 A 1 B 8 THR A 133 THR^? 12.71 S DMS A 178 coo 40.52 16.08 100.90 37.97 16.41 102.60 25.61 53.67 6.51 25.38 55.94 8.60 coo 36.11 13.64 95.03 34.54 14.86 95.91 22.43 45.95 3.80 21.34 47.68 4.53 coo 32.72 8.05 92.39 31.25 9.11 91.35 19.83 47.01 -4.10 19.79 49.09 -3.47 ULMN 3 1b01_d00 GENE REGULATION/DNA user 3 3 # 3 B 4 ARG A 82 ARG^? -14.39 O2 SO4 A 1s B 6 THR A 97 THR^? 10.77 O DMS A 178 B 8 THR A 59 THR^? 7.83 S DMS A 178 coo 40.52 16.08 100.90 37.97 16.41 102.60 25.61 53.67 6.51 25.38 55.94 8.60 coo 36.11 13.64 95.03 34.54 14.86 95.91 27.56 50.69 -1.16 26.29 52.37 -0.75 coo 32.72 8.05 92.39 31.25 9.11 91.35 24.98 48.34 -6.06 23.76 49.55 -7.33 ULMN 3 1b01_d00 GENE REGULATION/DNA user 4 3 # 4 B 4 ARG A 138 ARG.? 11.04 O1 SO4 A 2 B 6 THR A 133 THR^? 12.71 S DMS A 178 B 8 THR A 59 THR^? 7.83 S DMS A 178 coo 40.52 16.08 100.90 37.97 16.41 102.60 13.38 45.25 -10.19 15.76 43.26 -10.33 coo 36.11 13.64 95.03 34.54 14.86 95.91 19.83 47.01 -4.10 19.79 49.09 -3.47 coo 32.72 8.05 92.39 31.25 9.11 91.35 24.98 48.34 -6.06 23.76 49.55 -7.33 1b01_d00 source 1b01 GENE REGULATION/DNA : 4 hits 1b01_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 42 TYR.? 7.48 O3 SO4 A 1 I 306 VAL A 44 VAL^? 12.13 O2 SO4 A 1 I 308 VAL A 115 VAL^? 9.27 O2 SO4 A 1 coo 26.18 35.24 6.87 24.33 35.18 8.97 34.69 37.67 18.30 34.25 39.71 19.91 coo 23.55 29.53 9.81 23.15 27.39 10.24 34.54 36.47 10.07 36.41 37.00 9.03 coo 16.43 30.18 9.35 15.05 30.67 11.01 32.18 41.39 8.24 30.22 41.98 9.13 1cqt_d00 source 1cqt GENE REGULATION/DNA : 1 hits 1cqt_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 66 PRO^? 12.53 O2 SO4 A 1 A 272 LEU A 65 LEU^? 9.93 O2 SO4 A 1 A 276 ARG A 85 ARG^? -3.54 O2 SO4 A 1s coo 16.45 -2.42 17.59 14.58 -2.74 16.47 23.88 38.64 15.15 22.63 40.53 15.13 coo 10.97 0.43 16.73 11.31 2.11 18.06 24.51 42.75 12.75 26.14 42.89 11.35 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 28.11 50.34 16.85 30.45 48.42 16.82 1emh_d00 source 1emh HYDROLASE/DNA : 1 hits 1emh_d00 naa= 3 ULMN 3 2hos_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 5 ARG A 82 ARG^? -14.39 O2 SO4 A 1s A 50 LYS A 88 LYS.? 16.13 O4 SO4 A 1 A 51 ASN A 86 ASN.? 11.88 O4 SO4 A 1 coo 28.68 23.77 42.74 27.76 26.72 42.93 25.61 53.67 6.51 25.38 55.94 8.60 coo 14.40 30.33 40.28 14.25 28.31 45.36 23.95 50.46 23.69 18.95 48.60 24.87 coo 19.09 30.55 41.51 19.09 28.89 42.82 21.13 50.35 19.09 21.99 48.83 20.31 2hos_d00 source 2hos TRANSCRIPTION/DNA : 1 hits 2hos_d00 naa= 3 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 B 34 SER A 89 SER.? 8.54 O4 SO4 A 1 B 37 ASN A 86 ASN.? 11.88 O4 SO4 A 1 B 45 THR A 62 THR^? 16.82 O2 SO4 A 1 coo -19.49 41.97 71.08 -17.37 40.80 71.17 26.71 50.67 21.06 27.81 52.31 22.43 coo -23.05 39.62 69.74 -22.86 39.59 67.61 21.13 50.35 19.09 21.99 48.83 20.31 coo -30.87 34.84 80.57 -28.94 34.51 81.49 22.43 45.95 3.80 21.34 47.68 4.53 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 B 34 SER A 89 SER.? 8.54 O4 SO4 A 1 B 37 ASN A 86 ASN.? 11.88 O4 SO4 A 1 B 45 THR A 95 THR^? 15.56 O2 SO4 A 1 coo -19.49 41.97 71.08 -17.37 40.80 71.17 26.71 50.67 21.06 27.81 52.31 22.43 coo -23.05 39.62 69.74 -22.86 39.59 67.61 21.13 50.35 19.09 21.99 48.83 20.31 coo -30.87 34.84 80.57 -28.94 34.51 81.49 25.71 48.41 4.64 24.05 49.71 4.12 2z3x_d00 source 2z3x DNA BINDING PROTEIN/DNA : 2 hits 2z3x_d00 naa= 3 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 1 3 # 1 A 130 SER A 43 SER^? 13.97 O3 SO4 A 1 A 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 A 182 PHE A 128 PHE.? 14.82 O2 SO4 A 1 coo -46.28 37.24 81.97 -44.96 39.32 82.40 33.62 34.96 13.43 32.50 32.81 13.84 coo -36.62 39.62 84.60 -38.76 41.24 85.25 26.69 38.12 4.39 26.04 38.09 7.10 coo -36.55 45.66 79.22 -38.34 43.94 80.53 23.33 37.19 9.54 25.10 36.11 11.45 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 2 3 # 2 A 130 SER A 43 SER^? 13.97 O3 SO4 A 1 A 166 PHE A 128 PHE.? 14.82 O2 SO4 A 1 A 182 PHE A 47 PHE^? 15.27 O2 SO4 A 1 coo -46.28 37.24 81.97 -44.96 39.32 82.40 33.62 34.96 13.43 32.50 32.81 13.84 coo -36.62 39.62 84.60 -38.76 41.24 85.25 23.33 37.19 9.54 25.10 36.11 11.45 coo -36.55 45.66 79.22 -38.34 43.94 80.53 26.69 38.12 4.39 26.04 38.09 7.10 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 3 3 # 3 A 130 SER A 93 SER^? 13.00 O2 SO4 A 1 A 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 A 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -46.28 37.24 81.97 -44.96 39.32 82.40 23.28 46.46 10.67 22.30 48.49 9.75 coo -36.62 39.62 84.60 -38.76 41.24 85.25 26.69 38.12 4.39 26.04 38.09 7.10 coo -36.55 45.66 79.22 -38.34 43.94 80.53 28.99 42.21 0.26 28.17 43.32 -2.14 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 4 3 # 4 A 130 SER A 116 SER^? 9.01 O2 SO4 A 1 A 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 A 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -46.28 37.24 81.97 -44.96 39.32 82.40 33.87 40.25 11.45 36.10 40.15 10.56 coo -36.62 39.62 84.60 -38.76 41.24 85.25 26.69 38.12 4.39 26.04 38.09 7.10 coo -36.55 45.66 79.22 -38.34 43.94 80.53 28.99 42.21 0.26 28.17 43.32 -2.14 2r11_o00 source 2R11 CARBOXYLESTERASE NP : 4 hits 2r11_o00 naa= 3 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 1 3 # 1 B 130 SER A 43 SER^? 13.97 O3 SO4 A 1 B 166 PHE A 128 PHE.? 14.82 O2 SO4 A 1 B 182 PHE A 47 PHE^? 15.27 O2 SO4 A 1 coo -19.94 46.29 97.83 -22.38 46.56 97.60 33.62 34.96 13.43 32.50 32.81 13.84 coo -29.59 43.40 95.66 -28.22 45.54 94.50 23.33 37.19 9.54 25.10 36.11 11.45 coo -32.72 50.15 98.46 -30.32 48.85 97.77 26.69 38.12 4.39 26.04 38.09 7.10 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 2 3 # 2 B 130 SER A 93 SER^? 13.00 O2 SO4 A 1 B 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 B 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -19.94 46.29 97.83 -22.38 46.56 97.60 23.28 46.46 10.67 22.30 48.49 9.75 coo -29.59 43.40 95.66 -28.22 45.54 94.50 26.69 38.12 4.39 26.04 38.09 7.10 coo -32.72 50.15 98.46 -30.32 48.85 97.77 28.99 42.21 0.26 28.17 43.32 -2.14 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 3 3 # 3 B 130 SER A 116 SER^? 9.01 O2 SO4 A 1 B 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 B 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -19.94 46.29 97.83 -22.38 46.56 97.60 33.87 40.25 11.45 36.10 40.15 10.56 coo -29.59 43.40 95.66 -28.22 45.54 94.50 26.69 38.12 4.39 26.04 38.09 7.10 coo -32.72 50.15 98.46 -30.32 48.85 97.77 28.99 42.21 0.26 28.17 43.32 -2.14 2r11_o01 source 2R11 CARBOXYLESTERASE NP : 3 hits 2r11_o01 naa= 3 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 1 3 # 1 C 130 SER A 43 SER^? 13.97 O3 SO4 A 1 C 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 C 182 PHE A 128 PHE.? 14.82 O2 SO4 A 1 coo -2.19 64.27 51.12 -3.34 62.10 50.60 33.62 34.96 13.43 32.50 32.81 13.84 coo -11.14 61.91 46.89 -9.88 60.30 48.76 26.69 38.12 4.39 26.04 38.09 7.10 coo -7.71 55.92 42.70 -7.18 57.60 44.85 23.33 37.19 9.54 25.10 36.11 11.45 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 2 3 # 2 C 130 SER A 43 SER^? 13.97 O3 SO4 A 1 C 166 PHE A 128 PHE.? 14.82 O2 SO4 A 1 C 182 PHE A 47 PHE^? 15.27 O2 SO4 A 1 coo -2.19 64.27 51.12 -3.34 62.10 50.60 33.62 34.96 13.43 32.50 32.81 13.84 coo -11.14 61.91 46.89 -9.88 60.30 48.76 23.33 37.19 9.54 25.10 36.11 11.45 coo -7.71 55.92 42.70 -7.18 57.60 44.85 26.69 38.12 4.39 26.04 38.09 7.10 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 3 3 # 3 C 130 SER A 93 SER^? 13.00 O2 SO4 A 1 C 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 C 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -2.19 64.27 51.12 -3.34 62.10 50.60 23.28 46.46 10.67 22.30 48.49 9.75 coo -11.14 61.91 46.89 -9.88 60.30 48.76 26.69 38.12 4.39 26.04 38.09 7.10 coo -7.71 55.92 42.70 -7.18 57.60 44.85 28.99 42.21 0.26 28.17 43.32 -2.14 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 4 3 # 4 C 130 SER A 116 SER^? 9.01 O2 SO4 A 1 C 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 C 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -2.19 64.27 51.12 -3.34 62.10 50.60 33.87 40.25 11.45 36.10 40.15 10.56 coo -11.14 61.91 46.89 -9.88 60.30 48.76 26.69 38.12 4.39 26.04 38.09 7.10 coo -7.71 55.92 42.70 -7.18 57.60 44.85 28.99 42.21 0.26 28.17 43.32 -2.14 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 5 3 # 5 C 130 SER A 116 SER^? 9.01 O2 SO4 A 1 C 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 C 182 PHE A 128 PHE.? 14.82 O2 SO4 A 1 coo -2.19 64.27 51.12 -3.34 62.10 50.60 33.87 40.25 11.45 36.10 40.15 10.56 coo -11.14 61.91 46.89 -9.88 60.30 48.76 26.69 38.12 4.39 26.04 38.09 7.10 coo -7.71 55.92 42.70 -7.18 57.60 44.85 23.33 37.19 9.54 25.10 36.11 11.45 2r11_o02 source 2R11 CARBOXYLESTERASE NP : 5 hits 2r11_o02 naa= 3 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 1 3 # 1 D 130 SER A 43 SER^? 13.97 O3 SO4 A 1 D 166 PHE A 128 PHE.? 14.82 O2 SO4 A 1 D 182 PHE A 47 PHE^? 15.27 O2 SO4 A 1 coo -32.42 55.27 46.18 -30.51 54.94 47.67 33.62 34.96 13.43 32.50 32.81 13.84 coo -23.62 58.20 50.84 -23.76 56.14 48.96 23.33 37.19 9.54 25.10 36.11 11.45 coo -23.08 51.44 54.96 -24.43 52.71 52.88 26.69 38.12 4.39 26.04 38.09 7.10 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 2 3 # 2 D 130 SER A 93 SER^? 13.00 O2 SO4 A 1 D 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 D 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -32.42 55.27 46.18 -30.51 54.94 47.67 23.28 46.46 10.67 22.30 48.49 9.75 coo -23.62 58.20 50.84 -23.76 56.14 48.96 26.69 38.12 4.39 26.04 38.09 7.10 coo -23.08 51.44 54.96 -24.43 52.71 52.88 28.99 42.21 0.26 28.17 43.32 -2.14 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 3 3 # 3 D 130 SER A 116 SER^? 9.01 O2 SO4 A 1 D 166 PHE A 47 PHE^? 15.27 O2 SO4 A 1 D 182 PHE A 113 PHE^? 15.54 C2 DMS A 178 coo -32.42 55.27 46.18 -30.51 54.94 47.67 33.87 40.25 11.45 36.10 40.15 10.56 coo -23.62 58.20 50.84 -23.76 56.14 48.96 26.69 38.12 4.39 26.04 38.09 7.10 coo -23.08 51.44 54.96 -24.43 52.71 52.88 28.99 42.21 0.26 28.17 43.32 -2.14 2r11_o03 source 2R11 CARBOXYLESTERASE NP : 3 hits 2r11_o03 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 52 GLU.? 9.01 O1 SO4 A 2 B 44 ASP A 136 ASP.? 13.48 S DMS A 178 B 50 THR A 55 THR.? 14.77 C2 DMS A 178 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 19.92 35.92 -8.58 19.02 34.66 -7.12 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 16.93 48.70 -12.63 16.40 46.97 -11.55 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 20.53 43.58 -16.97 18.67 43.94 -17.93 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU A 131 GLU^? 11.19 O4 SO4 A 2 B 44 ASP A 84 ASP^? 13.05 O2 SO4 A 1 B 50 THR A 95 THR^? 15.56 O2 SO4 A 1 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 16.73 44.79 3.18 14.87 44.10 2.44 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 23.67 51.39 11.69 23.63 52.86 10.15 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 25.71 48.41 4.64 24.05 49.71 4.12 3hde_o01 source 3HDE LYSOZYME : 2 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 52 GLU.? 9.01 O1 SO4 A 2 C 44 ASP A 136 ASP.? 13.48 S DMS A 178 C 50 THR A 55 THR.? 14.77 C2 DMS A 178 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 19.92 35.92 -8.58 19.02 34.66 -7.12 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 16.93 48.70 -12.63 16.40 46.97 -11.55 coo 25.48 4.87 1.60 23.90 4.95 0.15 20.53 43.58 -16.97 18.67 43.94 -17.93 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU A 131 GLU^? 11.19 O4 SO4 A 2 C 44 ASP A 84 ASP^? 13.05 O2 SO4 A 1 C 50 THR A 95 THR^? 15.56 O2 SO4 A 1 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 16.73 44.79 3.18 14.87 44.10 2.44 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 23.67 51.39 11.69 23.63 52.86 10.15 coo 25.48 4.87 1.60 23.90 4.95 0.15 25.71 48.41 4.64 24.05 49.71 4.12 3hde_o02 source 3HDE LYSOZYME : 2 hits 3hde_o02 naa= 3 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 1 3 # 1 A 966 SER A 70 SER^? -2.62 O3 SO4 A 1s A 967 ARG A 69 ARG.? -8.24 O4 SO4 A 1s A 975 TYR A 42 TYR.? 7.48 O3 SO4 A 1 coo 82.02 40.88 31.11 79.88 41.56 30.18 31.92 44.17 17.73 34.19 43.63 17.15 coo 78.94 44.79 33.75 77.86 47.56 32.82 28.95 44.37 23.81 27.57 47.11 23.80 coo 83.57 40.86 25.45 83.15 43.18 26.91 34.69 37.67 18.30 34.25 39.71 19.91 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 2 3 # 2 A 966 SER A 70 SER^? -2.62 O3 SO4 A 1s A 967 ARG A 72 ARG^? 6.20 O1 SO4 A 1 A 975 TYR A 42 TYR.? 7.48 O3 SO4 A 1 coo 82.02 40.88 31.11 79.88 41.56 30.18 31.92 44.17 17.73 34.19 43.63 17.15 coo 78.94 44.79 33.75 77.86 47.56 32.82 37.15 44.99 14.21 40.05 45.65 13.45 coo 83.57 40.86 25.45 83.15 43.18 26.91 34.69 37.67 18.30 34.25 39.71 19.91 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 3 3 # 3 A 966 SER A 116 SER^? 9.01 O2 SO4 A 1 A 967 ARG A 72 ARG^? 6.20 O1 SO4 A 1 A 975 TYR A 42 TYR.? 7.48 O3 SO4 A 1 coo 82.02 40.88 31.11 79.88 41.56 30.18 33.87 40.25 11.45 36.10 40.15 10.56 coo 78.94 44.79 33.75 77.86 47.56 32.82 37.15 44.99 14.21 40.05 45.65 13.45 coo 83.57 40.86 25.45 83.15 43.18 26.91 34.69 37.67 18.30 34.25 39.71 19.91 4dqk_o00 source 4DQK BIFUNCTIONAL P-450/NADPH-P450 REDUCTASE : 3 hits 4dqk_o00 naa= 3