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Receptor
PDB id Resolution Class Description Source Keywords
2PD3 2.5 Å EC: 1.3.1.9 CRYSTAL STRUCTURE OF THE HELICOBACTER PYLORI ENOYL-ACYL CARRIER PROTEIN REDUCTASE IN COMPLEX WITH HYDROXYDIPHENYL E THER COMPOUNDS, TRICLOSAN AND DICLOSAN HELICOBACTER PYLORI ANTIBACTERIAL TARGET HELICOBACTER PYLORI TYPE II FATTY ACID BIOSYNTHESIS ENOYL-ACP-REDUCTASE FABI OXIDOREDUCTAS
Ref.: CRYSTAL STRUCTURE OF THE HELICOBACTER PYLORI ENOYL-ACYL CARRIER PROTEIN REDUCTASE IN COMPLEX WITH HYDROXYDIPHENYL ETHER COMPOUNDS, TRICLOSAN AND DICLOSAN PROTEINS V. 69 691 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NAD A:1780;
B:2780;
C:3780;
D:4780;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
TCL A:2414;
B:3414;
C:4414;
D:5414;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
289.542 C12 H7 Cl3 O2 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2PD4 2.3 Å EC: 1.3.1.9 CRYSTAL STRUCTURE OF THE HELICOBACTER PYLORI ENOYL-ACYL CARRIER PROTEIN REDUCTASE IN COMPLEX WITH HYDROXYDIPHENYL E THER COMPOUNDS, TRICLOSAN AND DICLOSAN HELICOBACTER PYLORI ANTIBACTERIAL TARGET HELICOBACTER PYLORI TYPE II FATTY ACID BIOSYNTHESIS ENOYL-ACP-REDUCTASE FABI OXIDOREDUCTAS
Ref.: CRYSTAL STRUCTURE OF THE HELICOBACTER PYLORI ENOYL-ACYL CARRIER PROTEIN REDUCTASE IN COMPLEX WITH HYDROXYDIPHENYL ETHER COMPOUNDS, TRICLOSAN AND DICLOSAN PROTEINS V. 69 691 2007
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 16 families.
1 2PD4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 2PD3 - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 9 families.
1 2PD4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 2PD3 - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
50% Homology Family (143)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 3PJD ic50 = 380 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
2 1QSG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
3 1DFG - NAD NDT n/a n/a
4 1I30 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
5 1DFH - NAD TDB n/a n/a
6 1QG6 Kd = 22 pM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
7 4CV2 - PT6 C19 H20 N2 O2 S Cc1c(cccc1....
8 4D46 - J47 C13 H7 Br Cl N O2 c1cc(c(cc1....
9 1C14 ic50 = 120 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
10 1LXC ic50 = 0.37 uM AYM C19 H20 N4 O Cn1c2ccccc....
11 1MFP ic50 = 0.07 uM IDN C22 H22 N4 O2 Cn1cc(c2c1....
12 4CV3 Ki = 7 nM VT4 C19 H25 N O2 CCCCCCC1=C....
13 1DFI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
14 1D8A - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
15 3PJE ic50 = 470 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
16 1LX6 - ZAM C22 H26 N4 O2 CC(=O)N(C)....
17 3PJF ic50 = 68500 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
18 4BNK Ki = 1.42 nM FPL C12 H9 F O2 c1ccc(cc1)....
19 4ALI - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
20 4CV0 - PT6 C19 H20 N2 O2 S Cc1c(cccc1....
21 4D41 Ki = 0.05 nM JA1 C18 H21 N O4 CCCCCCc1cc....
22 4BNG Ki = 0.04 nM 5PP C17 H20 O2 CCCCCc1ccc....
23 4BNL Ki = 110 pM W1G C15 H14 O2 C=CCc1ccc(....
24 4D45 Ki = 0.17 nM J47 C13 H7 Br Cl N O2 c1cc(c(cc1....
25 4BNM - TCU C19 H24 O2 CCCCCCc1cc....
26 4ALK - GLU C5 H9 N O4 C(CC(=O)O)....
27 3GR6 Kd = 18.6 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
28 4BNH Ki = 10 pM 6PN C18 H22 O2 CCCCCCc1cc....
29 4BNI Ki = 120 pM P1F C18 H23 N O2 CCCCCCc1cc....
30 4BNN Ki = 120 pM JUS C19 H21 N O2 CCCCCCc1cc....
31 4CV1 - PT6 C19 H20 N2 O2 S Cc1c(cccc1....
32 4BNJ Ki = 380 pM MJ5 C13 H12 O2 Cc1ccc(c(c....
33 4FS3 Ki = 12.8 nM 0WE C22 H23 N3 O3 Cc1c2ccccc....
34 4D44 Ki = 0.35 nM JA3 C13 H11 F2 N O2 CCc1cc(c(c....
35 4D43 Ki = 0.75 nM 9W7 C14 H11 Cl F N O4 CCc1cc(c(c....
36 4ALJ - GLU C5 H9 N O4 C(CC(=O)O)....
37 4BNF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
38 4D42 Ki = 0.01 nM W0I C18 H21 F O2 CCCCCCc1cc....
39 5CPB - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
40 5MTR Ki = 350 nM XT0 C21 H20 N4 O2 c1ccc(c(c1....
41 4BGI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
42 4OHU Ki = 0.2 nM 2TK C18 H21 Br O2 CCCCCCc1cc....
43 4OIM Ki = 2.14 nM JUS C19 H21 N O2 CCCCCCc1cc....
44 2IDZ Kd < 0.4 nM ZID C27 H30 N8 O15 P2 c1cnccc1C(....
45 2AQH Kd = 14.9 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
46 6EP8 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
47 4BII - PYW C27 H32 N4 O8 CC/C(=C1/C....
48 3FNG ic50 = 110 nM JPL C19 H20 Cl2 O2 c1cc(c(cc1....
49 2H9I - EAD C29 H36 N8 O15 P2 CCc1cc(ccn....
50 5OIC ic50 < 1 mM 9VQ C11 H12 N2 O c1cnn(c1)C....
51 1ENY - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
52 2NSD ic50 = 5.16 uM 4PI C20 H23 N O Cc1ccc(cc1....
53 2X23 Ki = 7.8 nM TCU C19 H24 O2 CCCCCCc1cc....
54 5G0U ic50 = 0.297 uM 9CV C30 H31 F N6 O2 CNC(=O)c1c....
55 4TRN - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
56 5OIM ic50 = 790 uM 9VZ C11 H15 N O2 S CCOC(=O)[C....
57 2X22 Ki = 7.8 nM TCU C19 H24 O2 CCCCCCc1cc....
58 4DQU - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
59 2IE0 - ZID C27 H30 N8 O15 P2 c1cnccc1C(....
60 4U0J ic50 = 10.66 uM 566 C17 H22 N2 O2 c1ccc(cc1)....
61 4COD ic50 = 34 nM KV1 C23 H27 N5 O4 CCc1cc(n(n....
62 5COQ Ki = 427.5 nM TCU C19 H24 O2 CCCCCCc1cc....
63 2AQ8 Kd = 2.5 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
64 4TZK ic50 = 0.39 uM 641 C17 H20 Cl2 N2 O2 c1c(cc(cc1....
65 4QXM ic50 = 0.05 uM 713 C20 H19 Cl F N3 O Cc1cc(n(n1....
66 4BGE - PYW C27 H32 N4 O8 CC/C(=C1/C....
67 2PR2 Ki = 130 nM DG1 C27 H33 N8 O18 P3 c1cnccc1C(....
68 5OIR Kd = 6.3 uM 9W8 C16 H20 N4 O CC1=CC(=O)....
69 2NTJ Ki = 2 nM P1H C30 H38 N8 O15 P2 CCCc1cc(cc....
70 5G0W ic50 = 16.3 uM 9NU C32 H40 N6 O5 C[C@H]([C@....
71 5MTP Ki = 610 nM 53K C22 H19 N3 O2 Cc1ccccc1O....
72 4TRJ ic50 = 0.89 uM 665 C17 H21 Br N2 O2 c1cc(cc(c1....
73 3FNF ic50 = 51 nM JPM C19 H14 Cl2 O2 c1ccc(cc1)....
74 4BQR ic50 = 0.2 uM IBH C16 H14 F2 N4 O2 S2 Cc1csc(n1)....
75 5VRM - 9JJ C35 H37 B F3 N7 O17 P2 B1(c2cc(cc....
76 4BQP Kd = 13.7 nM VMY C18 H16 F2 N6 O S2 Cc1csc(n1)....
77 5OIS ic50 = 500 nM 9WK C19 H18 Cl F N4 O Cc1cc(n(n1....
78 4OXK Ki = 40 nM 1S5 C19 H26 N2 O2 CCCCCCC1=C....
79 5UGU Ki = 370 nM XTV C19 H16 N4 O2 c1ccc(c(c1....
80 5OIP ic50 = 79 uM 9WE C16 H20 N6 O c1cc(cnc1)....
81 4OYR Ki = 0.96 nM 1US C18 H21 Cl O2 CCCCCCc1cc....
82 4DTI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
83 3OF2 Kd = 4.7 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
84 3OEY Kd = 3.5 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
85 2AQI Kd = 32 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
86 5G0S ic50 = 0.065 uM EEH C33 H40 N4 O4 S Cc1c2ccccc....
87 2NV6 ic50 = 323 nM ZID C27 H30 N8 O15 P2 c1cnccc1C(....
88 4U0K ic50 = 0.97 uM 744 C18 H23 Cl N2 O2 Cc1ccc(cc1....
89 4DRE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
90 4TRO Ki = 0.75 nM NAD ZID n/a n/a
91 2AQK Kd = 23 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
92 5OIF ic50 = 500 uM 9W5 C11 H13 N3 Cc1cc(n(n1....
93 5G0V ic50 = 5.917 uM JDD C24 H28 N6 O2 CNC(=O)CN(....
94 5G0T ic50 = 0.057 uM S72 C29 H35 F N6 O3 Cc1c(nnn1C....
95 2NTV Ki = 11 nM P1H C30 H38 N8 O15 P2 CCCc1cc(cc....
96 4OXY Ki = 129 nM 1TN C18 H21 N O4 CCCCCCc1cc....
97 2IEB - ZID C27 H30 N8 O15 P2 c1cnccc1C(....
98 3FNE ic50 = 29 nM 8PC C18 H13 Cl2 N O2 c1ccnc(c1)....
99 2B35 Ki = 0.22 uM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
100 4TZT ic50 = 23.12 uM 468 C18 H23 Cl N2 O2 Cc1c(cccc1....
101 4OXN Ki = 40 nM 1S5 C19 H26 N2 O2 CCCCCCC1=C....
102 5CP8 Ki = 1570.6 nM TCU C19 H24 O2 CCCCCCc1cc....
103 3OEW Kd = 1.5 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
104 1D7O - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
105 1CWU - NAD TDB n/a n/a
106 1ENO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
107 4BKU - 1S5 C19 H26 N2 O2 CCCCCCC1=C....
108 5I8W Ki = 55 nM 69H C19 H23 F O2 CCCCCCc1cc....
109 5I9M Ki = 55 nM 69K C14 H14 F N O2 CCc1cc(c(c....
110 5I8Z Ki = 158 nM JA1 C18 H21 N O4 CCCCCCc1cc....
111 5I7S Ki = 32 nM E9P C14 H14 O2 CCc1ccc(c(....
112 5I9L Ki = 153 nM 9W7 C14 H11 Cl F N O4 CCc1cc(c(c....
113 2WYV - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
114 2WYW - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
115 2ZTV - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
116 3LT4 Ki = 0.1 uM FB4 C12 H9 Cl2 N O2 c1cc(c(cc1....
117 3AM4 ic50 = 97 nM FT1 C13 H8 Cl2 O3 c1cc(c(cc1....
118 2O2Y Ki = 0.4 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
119 1VRW - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
120 1UH5 - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
121 3AM3 Ki = 28 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
122 3LT1 Ki = 0.32 uM FT2 C13 H9 Cl3 O2 c1cc(c(cc1....
123 4IGE ic50 = 0.25 uM CHJ C16 H11 Cl O4 CC1=CC(=O)....
124 2OL4 ic50 = 440 nM JPN C21 H18 Cl2 O2 c1ccc(cc1)....
125 3LT0 Ki = 0.18 uM FT1 C13 H8 Cl2 O3 c1cc(c(cc1....
126 3AM5 Ki = 38 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
127 4IGF ic50 = 6 uM CHV C15 H9 Cl O5 c1cc2c(cc1....
128 1ZK1 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
129 2WSB - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
130 5CG1 - NAD BBN n/a n/a
131 5CG2 - NAD CJ3 n/a n/a
132 5OVL - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
133 5YCS - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
134 2QIO ic50 = 3.6 uM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
135 3OJF ic50 = 0.06 uM IMJ C23 H24 N4 O2 Cc1c(c2ccc....
136 5YCR - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
137 3OIG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
138 4O1M - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
139 3OID - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
140 2PD4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
141 2PD3 - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
142 1EDO - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
143 4Q9N ic50 = 0.95 uM 0WE C22 H23 N3 O3 Cc1c2ccccc....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAD; Similar ligands found: 230
No: Ligand ECFP6 Tc MDL keys Tc
1 A3D 0.872727 0.986111
2 NHD 0.821429 0.972222
3 NAP 0.811966 0.986111
4 NFD 0.791304 0.946667
5 NXX 0.765766 0.972603
6 DND 0.765766 0.972603
7 AMP NAD 0.74359 0.972222
8 ZID 0.737705 0.986111
9 NAQ 0.729508 0.934211
10 NAE 0.721311 0.959459
11 NA0 0.712 0.972603
12 TAP 0.704 0.921053
13 NDE 0.689922 0.972603
14 NAJ 0.683333 0.972222
15 NDC 0.679389 0.934211
16 NDO 0.674603 0.958904
17 N01 0.656 0.972222
18 CNA 0.642276 0.972603
19 NBP 0.621212 0.922078
20 8ID 0.609756 0.922078
21 A2D 0.576923 0.958333
22 ADP 0.575472 0.931507
23 NGD 0.574803 0.922078
24 BA3 0.566038 0.958333
25 M33 0.564815 0.918919
26 ADP PO3 0.563636 0.957747
27 B4P 0.560748 0.958333
28 AP5 0.560748 0.958333
29 AN2 0.555556 0.918919
30 AT4 0.555556 0.894737
31 GAP 0.553571 0.932432
32 OOB 0.551724 0.972222
33 CA0 0.550459 0.932432
34 9JJ 0.546053 0.898734
35 HEJ 0.545455 0.931507
36 ACP 0.545455 0.906667
37 ATP 0.545455 0.931507
38 DQV 0.544 0.972222
39 ADP ALF 0.54386 0.883117
40 ALF ADP 0.54386 0.883117
41 DAL AMP 0.543103 0.945205
42 APR 0.540541 0.931507
43 AQP 0.540541 0.931507
44 AR6 0.540541 0.931507
45 5FA 0.540541 0.931507
46 ADP VO4 0.53913 0.945205
47 VO4 ADP 0.53913 0.945205
48 AD9 0.535714 0.906667
49 SAP 0.535714 0.883117
50 AGS 0.535714 0.883117
51 WAQ 0.533333 0.896104
52 ABM 0.53271 0.905405
53 DLL 0.529412 0.972222
54 00A 0.529412 0.921053
55 ACQ 0.526316 0.906667
56 NJP 0.526316 0.959459
57 ANP 0.526316 0.906667
58 OAD 0.525 0.932432
59 ADX 0.522523 0.839506
60 5AL 0.521739 0.945205
61 A1R 0.521008 0.871795
62 9SN 0.520325 0.909091
63 A 0.518868 0.930556
64 AMP 0.518868 0.930556
65 50T 0.517857 0.893333
66 ATF 0.517241 0.894737
67 1ZZ 0.516393 0.851852
68 3OD 0.516393 0.932432
69 SON 0.513514 0.92
70 PRX 0.513274 0.881579
71 6YZ 0.512821 0.906667
72 SRP 0.512821 0.92
73 9X8 0.512397 0.883117
74 ADP BMA 0.512397 0.932432
75 3UK 0.512397 0.958904
76 MYR AMP 0.512195 0.851852
77 NAJ PZO 0.510949 0.909091
78 NMN 0.509434 0.875
79 A3R 0.508333 0.871795
80 B5V 0.508197 0.945946
81 AMP DBH 0.507937 0.906667
82 A22 0.504202 0.945205
83 ATP A A A 0.504 0.971831
84 B5M 0.504 0.933333
85 FA5 0.504 0.945946
86 8QN 0.5 0.945205
87 NAX 0.496183 0.886076
88 TYR AMP 0.496063 0.933333
89 PR8 0.495935 0.8625
90 AMO 0.495868 0.92
91 ADQ 0.495868 0.932432
92 4AD 0.495868 0.933333
93 PAJ 0.495868 0.873418
94 A12 0.495495 0.894737
95 AP2 0.495495 0.894737
96 AHZ 0.492308 0.851852
97 YAP 0.492063 0.933333
98 FYA 0.491935 0.918919
99 AHX 0.491803 0.884615
100 4UU 0.488372 0.933333
101 5SV 0.487603 0.8375
102 TAT 0.487179 0.894737
103 T99 0.487179 0.894737
104 APC 0.486957 0.894737
105 SRA 0.486239 0.881579
106 6V0 0.484848 0.909091
107 NAI 0.484848 0.921053
108 GTA 0.484615 0.898734
109 A A 0.483871 0.958333
110 LAD 0.483871 0.873418
111 AU1 0.482456 0.906667
112 F2R 0.481752 0.831325
113 OMR 0.481203 0.841463
114 TXE 0.481203 0.921053
115 AF3 ADP 3PG 0.481203 0.873418
116 LAQ 0.480916 0.851852
117 G3A 0.48062 0.909091
118 B5Y 0.480315 0.933333
119 NB8 0.48 0.884615
120 TXA 0.48 0.92
121 BIS 0.48 0.871795
122 ME8 0.48 0.851852
123 PTJ 0.48 0.884615
124 139 0.477941 0.886076
125 LPA AMP 0.477273 0.851852
126 AFH 0.476923 0.873418
127 AR6 AR6 0.476923 0.958333
128 G5P 0.476923 0.909091
129 ARG AMP 0.476923 0.841463
130 25L 0.47619 0.945205
131 NAJ PYZ 0.475524 0.864198
132 25A 0.47541 0.958333
133 9ZA 0.47541 0.896104
134 9ZD 0.47541 0.896104
135 DZD 0.47482 0.897436
136 TXD 0.473684 0.921053
137 4UV 0.472868 0.933333
138 TYM 0.470149 0.945946
139 RBY 0.470085 0.894737
140 ADV 0.470085 0.894737
141 4TA 0.467626 0.864198
142 48N 0.466165 0.884615
143 XAH 0.465116 0.851852
144 4UW 0.462687 0.897436
145 M24 0.461538 0.886076
146 80F 0.460993 0.853659
147 IOT 0.459854 0.821429
148 T5A 0.456522 0.853659
149 EAD 0.455782 0.886076
150 MAP 0.455285 0.883117
151 GA7 0.454545 0.894737
152 BT5 0.453901 0.821429
153 A4P 0.452555 0.833333
154 UP5 0.451852 0.933333
155 PAP 0.445378 0.917808
156 4TC 0.445255 0.909091
157 AP0 0.445255 0.884615
158 YLP 0.444444 0.831325
159 P1H 0.443709 0.864198
160 AOC 0.442478 0.810811
161 Z5A 0.439189 0.833333
162 LMS 0.4375 0.817073
163 2A5 0.436975 0.857143
164 A G 0.43662 0.921053
165 G A A A 0.43662 0.909091
166 COD 0.43662 0.802326
167 ADJ 0.435714 0.841463
168 YLB 0.434783 0.831325
169 YLC 0.434783 0.851852
170 U A G G 0.433566 0.921053
171 ATR 0.433333 0.90411
172 7MD 0.432836 0.851852
173 8X1 0.432 0.764045
174 G5A 0.429752 0.790698
175 PO4 PO4 A A A A PO4 0.429688 0.943662
176 TAD 0.42963 0.873418
177 5AS 0.42735 0.770115
178 BTX 0.426573 0.831325
179 YLA 0.425532 0.831325
180 DSZ 0.425197 0.790698
181 NCN 0.424779 0.805556
182 UPA 0.42446 0.921053
183 8PZ 0.424242 0.811765
184 VMS 0.424 0.8
185 54H 0.424 0.8
186 9K8 0.423077 0.744444
187 N0B 0.422819 0.853659
188 6AD 0.422764 0.85
189 AYB 0.422535 0.821429
190 7D3 0.422414 0.844156
191 YLY 0.421769 0.821429
192 TSB 0.420635 0.809524
193 ODP 0.41958 0.922078
194 AV2 0.419355 0.855263
195 FB0 0.419355 0.775281
196 A5A 0.419355 0.819277
197 NNR 0.419048 0.739726
198 A A A 0.418605 0.918919
199 U A 0.417808 0.946667
200 649 0.417266 0.775281
201 NMN AMP PO4 0.416667 0.933333
202 SSA 0.416 0.790698
203 P5A 0.415385 0.755556
204 LSS 0.414062 0.772727
205 A2R 0.412698 0.918919
206 52H 0.412698 0.790698
207 JB6 0.412214 0.896104
208 5N5 0.411215 0.783784
209 YSA 0.410448 0.811765
210 53H 0.409449 0.790698
211 5CA 0.409449 0.790698
212 ITT 0.408333 0.878378
213 7D4 0.408333 0.844156
214 NA7 0.407692 0.894737
215 LEU LMS 0.407692 0.784091
216 5CD 0.407407 0.794521
217 0WD 0.406897 0.909091
218 A3P 0.40678 0.930556
219 HFD 0.406504 0.883117
220 AVV 0.40625 0.860759
221 RAB 0.40566 0.808219
222 XYA 0.40566 0.808219
223 ADN 0.40566 0.808219
224 FDA 0.405063 0.823529
225 GSU 0.40458 0.790698
226 7MC 0.404255 0.831325
227 NSS 0.403101 0.811765
228 6FA 0.402516 0.853659
229 PPS 0.4 0.817073
230 NVA LMS 0.4 0.784091
Ligand no: 2; Ligand: TCL; Similar ligands found: 15
No: Ligand ECFP6 Tc MDL keys Tc
1 TCL 1 1
2 FT3 0.666667 0.758621
3 FT2 0.652174 0.88
4 FT1 0.652174 0.916667
5 FB4 0.555556 0.709677
6 JPM 0.555556 0.88
7 JPJ 0.545455 0.88
8 JPA 0.535714 0.88
9 JPL 0.526316 0.758621
10 8PC 0.517241 0.6875
11 DCN 0.511111 1
12 JPN 0.508475 0.846154
13 CH8 0.489362 1
14 J47 0.454545 0.814815
15 43F 0.418182 0.777778
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2PD4; Ligand: NAD; Similar sites found with APoc: 437
This union binding pocket(no: 1) in the query (biounit: 2pd4.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
1 6BOC RIM None
2 6BOC EU7 None
3 4JGP PYR None
4 1ZEI CRS None
5 5U9J GER None
6 5UEX 89D None
7 2IXE ATP 1.10701
8 5E9W SAH 1.45455
9 5E8J SAH 1.45455
10 5W7M SAH 1.45455
11 2B4B COA 1.75439
12 1GZ6 NAI 1.81818
13 1N7G NDP 1.81818
14 2FR1 NDP 1.81818
15 6BWL NAD 1.81818
16 1N7G GDR 1.81818
17 5F5N NAD 1.81818
18 3W68 4PT 1.8797
19 5O96 SAM 2.04082
20 2BKA NDP 2.06612
21 5Y1G NAD 2.18182
22 5Y1G AKB 2.18182
23 1EK6 NAI 2.18182
24 1EK6 UPG 2.18182
25 1Z45 NAD 2.18182
26 5ZEC NAP 2.18182
27 1SB8 UD2 2.18182
28 1UDB NAD 2.18182
29 1UDB UFG 2.18182
30 1SB8 NAD 2.18182
31 1VL0 NAI 2.18182
32 1BW9 NAD 2.18182
33 2BMB PMM 2.18182
34 5VRH PLM 2.18182
35 2C29 DQH 2.18182
36 2D2I NAP 2.18182
37 2C29 NAP 2.18182
38 3B20 NAD 2.18182
39 5MSO NAP 2.21465
40 3WMX NAD 2.23464
41 3CM2 X23 2.30769
42 4QM7 GTP 2.33918
43 2XYQ SAH 2.45902
44 2DC1 CIT 2.54237
45 5K4W NAI 2.54545
46 5K4W THR 2.54545
47 1ORR NAD 2.54545
48 3R4S SLB 2.54545
49 1PJS NAD 2.54545
50 2PZM NAD 2.54545
51 2PZM UDP 2.54545
52 3BEO UDP 2.54545
53 5CX6 CDP 2.54545
54 3LKZ SFG 2.54545
55 3T64 DU3 2.76243
56 1PZM 5GP 2.8436
57 1L7N AF3 2.8436
58 1L7N ALF 2.8436
59 1VMK GUN 2.88809
60 3SJU NDP 2.90909
61 1Y1P NMN AMP PO4 2.90909
62 5JAQ NAI 2.90909
63 4PIV NDP 2.90909
64 3FSY SCA 2.90909
65 2Q1S NAI 2.90909
66 2HK9 ATR 2.90909
67 5MPT SAH 2.90909
68 1WVG APR 2.90909
69 5JJR SAH 2.90909
70 5WP5 SAH 2.90909
71 3KO0 TFP 2.9703
72 1EB9 HBA 3.05344
73 2JBH 5GP 3.11111
74 5MLR NAP 3.27273
75 5MLR GRQ 3.27273
76 5IN4 6CK 3.27273
77 5IN4 GDP 3.27273
78 5G4L NDP 3.27273
79 5IN4 NAP 3.27273
80 4ZRN NAD 3.27273
81 5L4L NAP 3.27273
82 4RDH AMP 3.27273
83 4OEV OXL 3.27273
84 1GV0 NAD 3.27273
85 4D79 ATP 3.27273
86 3H5N ATP 3.27273
87 3B1F NAD 3.27273
88 4RDI ATP 3.27273
89 6F8A HIS 3.27273
90 1RJD SAM 3.27273
91 2C5A GDC 3.27273
92 2C5A NAD 3.27273
93 6FDF SAH 3.27273
94 1GUZ NAD 3.27273
95 5L4L 7OX 3.27273
96 4OKD GLC GLC GLC 3.27273
97 1DSS NAD 3.27273
98 4ZRN UPG 3.27273
99 3DZ6 PUT 3.27273
100 1HDR NAD 3.27869
101 1UAY ADN 3.30579
102 4ZJS 4P0 3.47826
103 1BO4 COA 3.57143
104 4IRP UDP 3.58566
105 4GLL NAD 3.63636
106 2RH4 EMO 3.63636
107 2Q1W NAD 3.63636
108 3BP1 GUN 3.63636
109 2JL1 NAP 3.63636
110 1DNP MHF 3.63636
111 4GK9 MAN BMA MAN MAN MAN 3.63636
112 6CEP NAD 3.63636
113 5NM7 GLY 3.7594
114 2V6G NAP 4
115 1RPN NDP 4
116 1RKX NAD 4
117 1KEW NAD 4
118 1KEW TYD 4
119 6D6Y SAH 4
120 2PK3 A2R 4
121 1ZQ9 SAM 4
122 1JG9 GLC 4
123 1H82 GZZ 4
124 1H82 FAD 4
125 3O8M BGC 4
126 3O8M GLC 4
127 5EHS 2JJ 4.10448
128 5EHS 5OY 4.10448
129 1E3W NAD 4.21456
130 1E6W NAD 4.23077
131 4NTO 1PW 4.34783
132 1GY8 NAD 4.36364
133 1BXK NAD 4.36364
134 4RHS SIA SIA GAL 4.36364
135 1GPM AMP 4.36364
136 2ZWA SAH 4.36364
137 3O7W SAM 4.36364
138 5W7R SAH 4.36364
139 3EVG SAH 4.36364
140 2VUT NAD 4.36364
141 1TI7 NAP 4.36364
142 4Z0H NAD 4.36364
143 1LDN NAD 4.36364
144 1U7T TDT 4.5977
145 1U7T NAD 4.5977
146 3LU1 NAD 4.72727
147 3L9W AMP 4.72727
148 5BJX NAD 4.72727
149 1HYE NAP 4.72727
150 5BJX UDP 4.72727
151 1LDM NAD 4.72727
152 3MB5 SAM 4.72727
153 3TKY SAH 4.72727
154 4URG C2E 4.79042
155 6EL3 NAP 5.09091
156 4HXY NDP 5.09091
157 3A4V PYR 5.09091
158 3A4V NAD 5.09091
159 1CER NAD 5.09091
160 4HXY ACA 5.09091
161 1WDK NAD 5.17483
162 5OFW 9TW 5.38117
163 4TQG NDP 5.45455
164 1I2B USQ 5.45455
165 1I2B UPG 5.45455
166 1I2B NAD 5.45455
167 1OC2 NAD 5.45455
168 1OC2 TDX 5.45455
169 1HSR BHO 5.45455
170 3VPB GLU 5.45455
171 3R6K FUC GAL GLA 5.57377
172 4U7W NDP 5.81818
173 1F8G NAD 5.81818
174 4WZ6 ATP 5.81818
175 2GZ3 NAP 5.81818
176 1O6Z NAD 5.81818
177 3F81 STT 6.01093
178 5N53 8NB 6.15385
179 4J1Q NDP 6.18182
180 4PVD NDP 6.18182
181 6C4N NAP 6.18182
182 4OM8 NAD 6.18182
183 1ZGA SAH 6.18182
184 3CIF NAD 6.18182
185 3RJ5 NAD 6.29921
186 2Q46 NAP 6.32411
187 5WQP NCA 6.41026
188 5WQP NAP 6.41026
189 2XVM SAH 6.53266
190 1R6D NAD 6.54545
191 1R6D DAU 6.54545
192 2UYQ SAM 6.54545
193 1KYZ SAH 6.54545
194 5MB4 NAG 6.54545
195 1PL6 NAD 6.54545
196 5THZ SAH 6.54545
197 4KIB SAH 6.54545
198 5XXS COA 6.81818
199 2YY7 NAD 6.90909
200 1V6A TRE 6.90909
201 1E5Q NDP 6.90909
202 2HJR APR 6.90909
203 5L95 AMP 6.90909
204 3H8V ATP 6.90909
205 5THY SAH 6.90909
206 5MDH NAD 6.90909
207 4RM0 FUC NAG GAL 6.90909
208 3H9E NAD 6.90909
209 5YB7 ORN 6.90909
210 5YB7 FAD 6.90909
211 4KRI SAH 6.90909
212 2HMT NAI 6.94444
213 2PZE ATP 6.9869
214 4ZFL 4NK 7.26496
215 5KVS NAP 7.27273
216 5DF1 58X 7.63636
217 5DF1 NAP 7.63636
218 4E13 NAD 7.63636
219 2VYN NAD 7.63636
220 4OSP NAP 7.98479
221 5TH5 MET 7.98479
222 6C4T NA7 8
223 2WA2 SAM 8
224 4C4A SAH 8
225 1SU2 ATP 8.1761
226 5U6V 7WY 8.18182
227 4BCQ TJF 8.36364
228 5XWV 8H6 8.36364
229 5XWV NDP 8.36364
230 3X01 AMP 8.36364
231 3I6I NDP 8.36364
232 2AWN ADP 8.36364
233 3HRD NIO 8.36364
234 5FPE 3TR 8.36364
235 3B99 U51 8.72727
236 3KO8 NAD 9.09091
237 5YEC ATP 9.09091
238 2RHO GDP 9.09091
239 1HYH NAD 9.09091
240 1RZM E4P 9.09091
241 5OBU ANP 9.26276
242 2VT3 ATP 9.30233
243 1GU3 BGC BGC BGC BGC BGC 9.39597
244 1LTH NAD 9.45455
245 2F1K NAP 9.45455
246 5GT9 NAP 9.5057
247 4WXJ GLU 9.66543
248 6DNT NAD 9.81818
249 4LWP SAH 9.81818
250 1NVM NAD 9.81818
251 3V1U NAD 10.1818
252 1OAA OAA 10.4247
253 4LFL TG6 10.4938
254 3ACC 5GP 10.4972
255 1E7S NAP 10.5455
256 2G2Y MLI 10.5455
257 2GN4 UD1 10.9091
258 2GN4 NDP 10.9091
259 5ZZ6 NAD 10.9091
260 4D3F NAP 11.6129
261 5LD5 NAD 11.6364
262 5Z75 NAD 12
263 9LDT NAD 12.3636
264 9LDB NAD 12.3636
265 5O98 NAP 13.0909
266 3O26 NDP 13.0909
267 4R1S NAP 13.4545
268 5L4S 6KX 13.8182
269 5L4S NAP 13.8182
270 3RFV NAI 13.8577
271 3RFV 15L 13.8577
272 4YEF 4CQ 14.6067
273 1FK8 NAD 14.9091
274 1ZBQ NAD 15.2727
275 2DKN NAI 15.6863
276 5GWT NAD 16.3636
277 5GWT SIN 16.3636
278 2X6T NAP 16.3636
279 3ABI NAD 16.3636
280 1EQ2 NAP 16.3636
281 3H4V DVP 16.7273
282 3H4V NAP 16.7273
283 1LSS NAD 17.1429
284 4Y9D NAI 17.4545
285 5OBY ANP 17.8182
286 5OVK NDP 17.9688
287 5L53 NAP 18.1818
288 2OOR NAD 18.3908
289 1WMA NDP 18.5455
290 1WMA AB3 18.5455
291 1BDB NAD 19.2727
292 1MXH NAP 20
293 1MXH DHF 20
294 1Z6Z NAP 22.1818
295 4J7U NAP 22.1818
296 4J7U YTZ 22.1818
297 1IY8 NAD 22.8464
298 2BD0 NAP 22.9508
299 1A27 NAP 23.2727
300 3HB5 NAP 23.2727
301 3ORF NAD 23.506
302 3ICC NAP 23.5294
303 4YAC NAI 23.6364
304 3ZV6 4HB 24
305 3ZV6 NAD 24
306 1XKQ NDP 24.7273
307 4YAG NAI 25.4545
308 3WXB NDP 25.8182
309 4K26 NDP 26.9091
310 4K26 SFF 26.9091
311 3CH6 311 28
312 3CH6 NAP 28
313 1XSE NDP 28.3636
314 1JA9 NDP 28.8321
315 3RKR NAP 29.3893
316 1N5D NDP 29.8182
317 2CFC NAD 30
318 3U4C NDP 30.1818
319 1SNY NAP 30.3371
320 1XG5 NAP 30.9091
321 4EUE NAI 30.9091
322 3AY6 BGC 30.9091
323 3AY6 NAI 30.9091
324 3VZS CAA 30.9091
325 3VZS NAP 30.9091
326 1GEE NAD 31.0345
327 2BGM NAJ 31.2727
328 1ZEM NAD 31.2977
329 3TN7 NJP 31.5175
330 5EJ2 NAD 31.6364
331 5WUW NAP 31.6364
332 5OOH NAP 32.0388
333 5OOH 9ZZ 32.0388
334 4G5H UD7 32.3636
335 4G5H NAP 32.3636
336 6F9Q NAD 32.7273
337 2GDZ NAD 32.9588
338 1YXM ADE 33.0909
339 4FC7 NAP 33.4545
340 4FC7 COA 33.4545
341 4NBW NAD 33.463
342 4ZA2 NAD 33.5968
343 3GEG NAD 33.8182
344 4KWI 1TJ 33.8403
345 4KWI NAP 33.8403
346 1GEG NAD 34.9091
347 1W73 NAP 35.6364
348 1W8D NAP 35.6364
349 5O42 NAD 35.7664
350 5O42 9JW 35.7664
351 5O42 BGC 35.7664
352 5T2U NAP 36.2903
353 2JAH NDP 36.4372
354 4QED NAP 36.7273
355 1W6U NAP 37.0909
356 2B4Q NAP 37.4545
357 2JAP NDP 37.6518
358 4FN4 NAD 37.7953
359 1H5Q NAP 38.1132
360 4O0L NDP 38.1818
361 3QWI NAP 38.1818
362 3QWI CUE 38.1818
363 5THQ NDP 38.2353
364 3SJ7 NDP 38.4921
365 4RF2 NAP 38.6029
366 5FEU NAP 38.9091
367 1NFQ NAI 39.2727
368 1G0N NDP 39.2727
369 1G0N PHH 39.2727
370 3NUG NAD 39.6364
371 4CLO NAP 39.6364
372 3JQ8 NAP 39.6364
373 4CME NAP 39.6364
374 5OJI NAP 39.6364
375 3BMO NAP 39.6364
376 5JDI NAP 39.6364
377 5JDC NAP 39.6364
378 4CM8 NAP 39.6364
379 3BMQ NAP 39.6364
380 3JQG NAP 39.6364
381 5OJI ISN 39.6364
382 3JQF NAP 39.6364
383 5JCJ NAP 39.6364
384 4CMI NAP 39.6364
385 5K6A NAP 39.6364
386 3BMN NAP 39.6364
387 4CM9 NAP 39.6364
388 3JQB NAP 39.6364
389 4CLR NAP 39.6364
390 3JQA NAP 39.6364
391 3JQ7 NAP 39.6364
392 4CM4 NAP 39.6364
393 3JQ9 NAP 39.6364
394 3BMO AX4 39.6364
395 3JQG AX6 39.6364
396 3BMQ AX5 39.6364
397 3JQ8 DX3 39.6364
398 4CME KTZ 39.6364
399 1UZN NAP 39.6761
400 6CI9 NAP 40.1544
401 1HDC CBO 40.5512
402 2WD7 NAP 40.6716
403 2VZ0 NAP 40.6716
404 2VZ0 D64 40.6716
405 2Q2V NAD 40.7843
406 4ITU NAI 40.8922
407 4ITU 1HS 40.8922
408 1AE1 NAP 41.0256
409 2ZAT NAP 41.0909
410 2DTX BMA 41.2879
411 1O5I NAD 41.3655
412 5B4T 3HR 41.5385
413 5B4T NAD 41.5385
414 5FFF 5XC 41.6342
415 5FFF NAP 41.6342
416 4NBT NAD 41.8182
417 1X1T NAD 42.1818
418 5YSS NAD 42.1875
419 1Q7B NAP 42.2131
420 3AFN NAP 42.2481
421 4JP3 CIT 42.2594
422 3O03 NAP 42.5455
423 2EWM NAD 42.5703
424 1ZK4 NAP 42.6295
425 1ZK4 AC0 42.6295
426 3A28 NAD 42.6357
427 1VL8 NAP 42.6966
428 4NBU NAI 42.8
429 2AE2 NAP 43.4615
430 2AE2 PTO 43.4615
431 5EPO NAP 43.5115
432 5EPO TUD 43.5115
433 4CQM NAP 43.8525
434 1XHL NDP 44
435 4URF NAD 45.5645
436 5Z2L NDP 46.1224
437 2AG5 NAD 47.1545
438 3D3W NAP 50
439 1PR9 NAP 50
Pocket No.: 2; Query (leader) PDB : 2PD4; Ligand: NAD; Similar sites found with APoc: 43
This union binding pocket(no: 2) in the query (biounit: 2pd4.bio1) has 36 residues
No: Leader PDB Ligand Sequence Similarity
1 6FGL UO1 None
2 2OBM ADP 1.81818
3 1EJ0 SAM 2.22222
4 2PWY SAH 2.32558
5 2IZ1 ATR 2.54545
6 1QCI ADE 2.67176
7 2JHP SAH 2.90909
8 2B1N LYS ALA SER VAL GLY 3.25203
9 4M37 SAH 3.27273
10 3KB6 LAC 3.27273
11 4M38 SAH 3.27273
12 1RJW ETF 3.27273
13 1QAN SAH 3.27869
14 5ZZO FLC 3.48259
15 4GLW 0XT 3.63636
16 4N49 SAM 3.63636
17 3C3Y SAH 3.79747
18 4ZDM GLY 3.83142
19 4CJN QNZ 4
20 4MPO AMP 4.57516
21 2CBZ ATP 4.64135
22 3PT9 SAH 4.72727
23 3BBD SAH 5.36585
24 5KOK SAH 5.45455
25 5WXU FLC 6.54545
26 4KFU ACP 6.60377
27 6AYU F6P 7.27273
28 6A56 LAT 7.31707
29 5ERG SAM 7.63636
30 3G4Q MCH 8.21918
31 1Z0N BCD 8.33333
32 5AOV GLV 8.36364
33 2HIM ASN 8.36364
34 5NC1 NAG 8.43882
35 3UKR CKH 9.09091
36 4XB2 NDP 9.81818
37 1XFF GLU 10.8333
38 3V2U GLA 11.2727
39 2J5V PCA 14.1818
40 4B9Q ATP 14.9091
41 3ZIA ADP 19.6721
42 2V7Q ADP 26
43 2CFC KPC 30
Pocket No.: 3; Query (leader) PDB : 2PD4; Ligand: NAD; Similar sites found with APoc: 13
This union binding pocket(no: 3) in the query (biounit: 2pd4.bio1) has 36 residues
No: Leader PDB Ligand Sequence Similarity
1 3VPD CIT 2.18182
2 4ZGS NAD 2.90909
3 5LV1 78T 3.27273
4 5M37 9SZ 3.47826
5 3T5M AMP 4
6 1HDG NAD 4
7 1Y8Q ATP 4.36364
8 1M1B SPV 5.45455
9 6AA8 NAD 6.54545
10 4LHD GLY 7.63636
11 3R7F CP 9.09091
12 5VKT NAP 9.09091
13 5ZZ6 ADP 10.9091
Pocket No.: 4; Query (leader) PDB : 2PD4; Ligand: DCN; Similar sites found with APoc: 407
This union binding pocket(no: 4) in the query (biounit: 2pd4.bio1) has 33 residues
No: Leader PDB Ligand Sequence Similarity
1 6BOC RIM None
2 4RJD TFP None
3 6BOC EU7 None
4 4JGP PYR None
5 1ZEI CRS None
6 5U9J GER None
7 6FGL UO1 None
8 5UEX 89D None
9 5E9W SAH 1.45455
10 5E8J SAH 1.45455
11 2B4B COA 1.75439
12 1GZ6 NAI 1.81818
13 1N7G NDP 1.81818
14 6BWL NAD 1.81818
15 2FR1 NDP 1.81818
16 1N7G GDR 1.81818
17 5F5N NAD 1.81818
18 3W68 4PT 1.8797
19 2BKA NDP 2.06612
20 5Y1G NAD 2.18182
21 1EK6 NAI 2.18182
22 1EK6 UPG 2.18182
23 5Y1G AKB 2.18182
24 1UDB NAD 2.18182
25 1UDB UFG 2.18182
26 1SB8 UD2 2.18182
27 1Z45 NAD 2.18182
28 5ZEC NAP 2.18182
29 1SB8 NAD 2.18182
30 1VL0 NAI 2.18182
31 2BMB PMM 2.18182
32 5VRH PLM 2.18182
33 2D2I NAP 2.18182
34 2C29 DQH 2.18182
35 1BW9 NAD 2.18182
36 3B20 NAD 2.18182
37 2C29 NAP 2.18182
38 5MSO NAP 2.21465
39 3WMX NAD 2.23464
40 3CM2 X23 2.30769
41 4QM7 GTP 2.33918
42 2DC1 CIT 2.54237
43 5K4W NAI 2.54545
44 5K4W THR 2.54545
45 1ORR NAD 2.54545
46 3R4S SLB 2.54545
47 1PJS NAD 2.54545
48 2PZM UDP 2.54545
49 2PZM NAD 2.54545
50 3T64 DU3 2.76243
51 1L7N AF3 2.8436
52 1PZM 5GP 2.8436
53 1VMK GUN 2.88809
54 3SJU NDP 2.90909
55 1Y1P NMN AMP PO4 2.90909
56 5JAQ NAI 2.90909
57 4PIV NDP 2.90909
58 2Q1S NAI 2.90909
59 1WVG APR 2.90909
60 2HK9 ATR 2.90909
61 4B4U NAP 2.90909
62 1UWK NAD 2.90909
63 1UWK URO 2.90909
64 1EB9 HBA 3.05344
65 2JBH 5GP 3.11111
66 5MLR GRQ 3.27273
67 5MLR NAP 3.27273
68 5IN4 6CK 3.27273
69 5IN4 GDP 3.27273
70 5IN4 NAP 3.27273
71 5G4L NDP 3.27273
72 4ZRN UPG 3.27273
73 4ZRN NAD 3.27273
74 4OEV OXL 3.27273
75 1GV0 NAD 3.27273
76 5L4L NAP 3.27273
77 3H5N ATP 3.27273
78 4D79 ATP 3.27273
79 4RDH AMP 3.27273
80 6F8A HIS 3.27273
81 3B1F NAD 3.27273
82 2C5A GDC 3.27273
83 2C5A NAD 3.27273
84 1RJD SAM 3.27273
85 5L4L 7OX 3.27273
86 4OKD GLC GLC GLC 3.27273
87 4RDI ATP 3.27273
88 1DSS NAD 3.27273
89 1GUZ NAD 3.27273
90 3DZ6 PUT 3.27273
91 1HDR NAD 3.27869
92 1UAY ADN 3.30579
93 4ZJS 4P0 3.47826
94 4H69 10Y 3.60825
95 4GLL NAD 3.63636
96 2RH4 EMO 3.63636
97 2Q1W NAD 3.63636
98 1DNP MHF 3.63636
99 4GK9 MAN BMA MAN MAN MAN 3.63636
100 1T36 ORN 3.63636
101 6CEP OXM 3.63636
102 6CEP NAD 3.63636
103 5N0F 7K2 3.63636
104 2JL1 NAP 3.63636
105 2VVL FAD 3.63636
106 5NM7 GLY 3.7594
107 2V6G NAP 4
108 1RKX NAD 4
109 1RPN NDP 4
110 1KEW NAD 4
111 1KEW TYD 4
112 2PK3 A2R 4
113 1ZQ9 SAM 4
114 1JG9 GLC 4
115 5EHS 2JJ 4.10448
116 5EHS 5OY 4.10448
117 4HBM 0Y7 4.16667
118 1E3W NAD 4.21456
119 1E6W NAD 4.23077
120 4OWK NGA 4.34783
121 1GY8 NAD 4.36364
122 1BXK NAD 4.36364
123 4RHS SIA SIA GAL 4.36364
124 3O7W SAM 4.36364
125 2ZWA SAH 4.36364
126 1GPM AMP 4.36364
127 1GY8 UDP 4.36364
128 2VUT NAD 4.36364
129 4Z0H NAD 4.36364
130 1TI7 NAP 4.36364
131 4MPO AMP 4.57516
132 1U7T TDT 4.5977
133 1U7T NAD 4.5977
134 3LU1 NAD 4.72727
135 3L9W AMP 4.72727
136 5BJX NAD 4.72727
137 5BJX UDP 4.72727
138 1HYE NAP 4.72727
139 1LDM NAD 4.72727
140 1P77 ATR 4.77941
141 5CSS G3P 4.86726
142 6EL3 NAP 5.09091
143 4HXY NDP 5.09091
144 3A4V PYR 5.09091
145 3A4V NAD 5.09091
146 1VPE 3PG 5.09091
147 4HXY ACA 5.09091
148 1V8B ADN 5.09091
149 1CER NAD 5.09091
150 5OFW 9TW 5.38117
151 4TQG NDP 5.45455
152 1I2B USQ 5.45455
153 1I2B NAD 5.45455
154 1I2B UPG 5.45455
155 1OC2 TDX 5.45455
156 1OC2 NAD 5.45455
157 3R6K FUC GAL GLA 5.57377
158 4U7W NDP 5.81818
159 2GZ3 NAP 5.81818
160 1O6Z NAD 5.81818
161 4WZ6 ATP 5.81818
162 1F8G NAD 5.81818
163 3F81 STT 6.01093
164 5N53 8NB 6.15385
165 4J1Q NDP 6.18182
166 4PVD NDP 6.18182
167 6C4N NAP 6.18182
168 4OM8 NAD 6.18182
169 3CIF NAD 6.18182
170 3RJ5 NAD 6.29921
171 2Q46 NAP 6.32411
172 5WQP NCA 6.41026
173 5WQP NAP 6.41026
174 2XVM SAH 6.53266
175 1R6D NAD 6.54545
176 1R6D DAU 6.54545
177 5MB4 NAG 6.54545
178 1PL6 NAD 6.54545
179 5UAV TFB 6.54545
180 5WXU FLC 6.54545
181 5XXS COA 6.81818
182 2YY7 NAD 6.90909
183 1V6A TRE 6.90909
184 2HJR APR 6.90909
185 1E5Q NDP 6.90909
186 5L95 AMP 6.90909
187 5MDH NAD 6.90909
188 5YB7 FAD 6.90909
189 5YB7 ORN 6.90909
190 3H8V ATP 6.90909
191 3H9E NAD 6.90909
192 2HMT NAI 6.94444
193 2PZE ATP 6.9869
194 4ZFL 4NK 7.26496
195 6A56 LAT 7.31707
196 5KEW 6SB 7.44681
197 5DF1 NAP 7.63636
198 5DF1 58X 7.63636
199 4E13 NAD 7.63636
200 2VYN NAD 7.63636
201 4OSP NAP 7.98479
202 5TH5 MET 7.98479
203 6C4T NA7 8
204 1SU2 ATP 8.1761
205 5U6V 7WY 8.18182
206 4BCQ TJF 8.36364
207 5XWV 8H6 8.36364
208 5XWV NDP 8.36364
209 3I6I NDP 8.36364
210 5FPE 3TR 8.36364
211 3B99 U51 8.72727
212 3KO8 NAD 9.09091
213 5YEC ATP 9.09091
214 3UKR CKH 9.09091
215 1HYH NAD 9.09091
216 5OBU ANP 9.26276
217 2VT3 ATP 9.30233
218 1GU3 BGC BGC BGC BGC BGC 9.39597
219 1LTH NAD 9.45455
220 2F1K NAP 9.45455
221 5GT9 NAP 9.5057
222 6DNT NAD 9.81818
223 1NVM NAD 9.81818
224 3V1U NAD 10.1818
225 1OAA OAA 10.4247
226 4LFL TG6 10.4938
227 3ACC 5GP 10.4972
228 1E7S NAP 10.5455
229 2GN4 UD1 10.9091
230 2GN4 NDP 10.9091
231 4D3F NAP 11.6129
232 5LD5 NAD 11.6364
233 5Z75 NAD 12
234 9LDT NAD 12.3636
235 9LDB NAD 12.3636
236 5O98 NAP 13.0909
237 3O26 NDP 13.0909
238 4R1S NAP 13.4545
239 5L4S NAP 13.8182
240 5L4S 6KX 13.8182
241 3RFV NAI 13.8577
242 3RFV 15L 13.8577
243 1YY5 FAD 14.1818
244 4YEF 4CQ 14.6067
245 1FK8 NAD 14.9091
246 1ZBQ NAD 15.2727
247 2DKN NAI 15.6863
248 5GWT NAD 16.3636
249 5GWT SIN 16.3636
250 2X6T NAP 16.3636
251 1EQ2 NAP 16.3636
252 3ABI NAD 16.3636
253 3H4V DVP 16.7273
254 3H4V NAP 16.7273
255 1LSS NAD 17.1429
256 4Y9D NAI 17.4545
257 5OBY ANP 17.8182
258 5OVK NDP 17.9688
259 5L53 NAP 18.1818
260 2OOR NAD 18.3908
261 1WMA AB3 18.5455
262 1WMA NDP 18.5455
263 1BDB NAD 19.2727
264 1MXH NAP 20
265 1MXH DHF 20
266 1Z6Z NAP 22.1818
267 4J7U NAP 22.1818
268 4J7U YTZ 22.1818
269 1IY8 NAD 22.8464
270 2BD0 NAP 22.9508
271 1A27 NAP 23.2727
272 3HB5 NAP 23.2727
273 3ORF NAD 23.506
274