Receptor
PDB id Resolution Class Description Source Keywords
2Q2V 1.9 Å EC: 1.1.1.30 STRUCTURE OF D-3-HYDROXYBUTYRATE DEHYDROGENASE FROM PSEUDOMO PSEUDOMONAS PUTIDA D-3-HYDROXYBUTYRATE DEHYDROGENASE PSEUDOMONAS PUTIDA SDR OXIDOREDUCTASE
Ref.: COSUBSTRATE-INDUCED DYNAMICS OF D-3-HYDROXYBUTYRATE DEHYDROGENASE FROM PSEUDOMONAS PUTIDA. FEBS J. V. 274 5767 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NAD B:300;
C:300;
D:300;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2Q2V 1.9 Å EC: 1.1.1.30 STRUCTURE OF D-3-HYDROXYBUTYRATE DEHYDROGENASE FROM PSEUDOMO PSEUDOMONAS PUTIDA D-3-HYDROXYBUTYRATE DEHYDROGENASE PSEUDOMONAS PUTIDA SDR OXIDOREDUCTASE
Ref.: COSUBSTRATE-INDUCED DYNAMICS OF D-3-HYDROXYBUTYRATE DEHYDROGENASE FROM PSEUDOMONAS PUTIDA. FEBS J. V. 274 5767 2007
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 2Q2V - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 2Q2Q - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2ZTL - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 2ZTU - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
3 2ZTM - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 1X1T - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
5 2ZTV - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
6 2Q2V - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
7 2Q2Q - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
8 5B4T - 3HR C4 H8 O3 C[C@H](CC(....
9 3VDQ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
10 5B4V - DXX C4 H6 O4 CC(C(=O)O)....
11 5B4U - MLA C3 H4 O4 C(C(=O)O)C....
50% Homology Family (169)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 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 1E3S - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
19 2VZ0 Ki = 9.8 nM D64 C15 H14 N4 Cc1ccc(cc1....
20 3MCV Ki = 70 nM MCV C16 H18 N4 O2 S COc1ccc(c(....
21 3JQD Ki = 0.71 uM DX7 C13 H9 N5 O c1ccc(cc1)....
22 4BNK Ki = 1.42 nM FPL C12 H9 F O2 c1ccc(cc1)....
23 4ALI - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
24 4CV0 - PT6 C19 H20 N2 O2 S Cc1c(cccc1....
25 4D41 Ki = 0.05 nM JA1 C18 H21 N O4 CCCCCCc1cc....
26 4BNG Ki = 0.04 nM 5PP C17 H20 O2 CCCCCc1ccc....
27 4BNL Ki = 110 pM W1G C15 H14 O2 C=CCc1ccc(....
28 4D45 Ki = 0.17 nM J47 C13 H7 Br Cl N O2 c1cc(c(cc1....
29 4BNM - TCU C19 H24 O2 CCCCCCc1cc....
30 4ALK - GLU C5 H9 N O4 C(CC(=O)O)....
31 3GR6 Kd = 18.6 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
32 4BNH Ki = 10 pM 6PN C18 H22 O2 CCCCCCc1cc....
33 4BNI Ki = 120 pM P1F C18 H23 N O2 CCCCCCc1cc....
34 4BNN Ki = 120 pM JUS C19 H21 N O2 CCCCCCc1cc....
35 4CV1 - PT6 C19 H20 N2 O2 S Cc1c(cccc1....
36 4BNJ Ki = 380 pM MJ5 C13 H12 O2 Cc1ccc(c(c....
37 4FS3 Ki = 12.8 nM 0WE C22 H23 N3 O3 Cc1c2ccccc....
38 4D44 Ki = 0.35 nM JA3 C13 H11 F2 N O2 CCc1cc(c(c....
39 4D43 Ki = 0.75 nM 9W7 C14 H11 Cl F N O4 CCc1cc(c(c....
40 4ALJ - GLU C5 H9 N O4 C(CC(=O)O)....
41 4BNF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
42 4D42 Ki = 0.01 nM W0I C18 H21 F O2 CCCCCCc1cc....
43 1W4Z - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
44 5CPB - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
45 5MTR Ki = 350 nM XT0 C21 H20 N4 O2 c1ccc(c(c1....
46 4BGI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
47 4OHU Ki = 0.2 nM 2TK C18 H21 Br O2 CCCCCCc1cc....
48 4OIM Ki = 2.14 nM JUS C19 H21 N O2 CCCCCCc1cc....
49 2IDZ Kd < 0.4 nM ZID C27 H30 N8 O15 P2 c1cnccc1C(....
50 2AQH Kd = 14.9 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
51 4BII - PYW C27 H32 N4 O8 CC/C(=C1/C....
52 3FNG ic50 = 110 nM JPL C19 H20 Cl2 O2 c1cc(c(cc1....
53 2H9I - EAD C29 H36 N8 O15 P2 CCc1cc(ccn....
54 1ENY - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
55 2NSD ic50 = 5.16 uM 4PI C20 H23 N O Cc1ccc(cc1....
56 2X23 Ki = 7.8 nM TCU C19 H24 O2 CCCCCCc1cc....
57 5G0U ic50 = 0.297 uM 9CV C30 H31 F N6 O2 CNC(=O)c1c....
58 4TRN - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
59 2X22 Ki = 7.8 nM TCU C19 H24 O2 CCCCCCc1cc....
60 4DQU - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
61 2IE0 - ZID C27 H30 N8 O15 P2 c1cnccc1C(....
62 4U0J ic50 = 10.66 uM 566 C17 H22 N2 O2 c1ccc(cc1)....
63 4COD ic50 = 34 nM KV1 C23 H27 N5 O4 CCc1cc(n(n....
64 5COQ Ki = 427.5 nM TCU C19 H24 O2 CCCCCCc1cc....
65 2AQ8 Kd = 2.5 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
66 4TZK ic50 = 0.39 uM 641 C17 H20 Cl2 N2 O2 c1c(cc(cc1....
67 4QXM ic50 = 0.05 uM 713 C20 H19 Cl F N3 O Cc1cc(n(n1....
68 4BGE - PYW C27 H32 N4 O8 CC/C(=C1/C....
69 2PR2 Ki = 130 nM DG1 C27 H33 N8 O18 P3 c1cnccc1C(....
70 2NTJ Ki = 2 nM P1H C30 H38 N8 O15 P2 CCCc1cc(cc....
71 5G0W ic50 = 16.3 uM 9NU C32 H40 N6 O5 C[C@H]([C@....
72 5MTP Ki = 610 nM 53K C22 H19 N3 O2 Cc1ccccc1O....
73 4TRJ ic50 = 0.89 uM 665 C17 H21 Br N2 O2 c1cc(cc(c1....
74 3FNF ic50 = 51 nM JPM C19 H14 Cl2 O2 c1ccc(cc1)....
75 4BQR ic50 = 0.2 uM IBH C16 H14 F2 N4 O2 S2 Cc1csc(n1)....
76 4BQP Kd = 13.7 nM VMY C18 H16 F2 N6 O S2 Cc1csc(n1)....
77 4OXK Ki = 40 nM 1S5 C19 H26 N2 O2 CCCCCCC1=C....
78 5UGU Ki = 370 nM XTV C19 H16 N4 O2 c1ccc(c(c1....
79 4OYR Ki = 0.96 nM 1US C18 H21 Cl O2 CCCCCCc1cc....
80 4DTI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
81 3OF2 Kd = 4.7 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
82 3OEY Kd = 3.5 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
83 2AQI Kd = 32 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
84 5G0S ic50 = 0.065 uM EEH C33 H40 N4 O4 S Cc1c2ccccc....
85 2NV6 ic50 = 323 nM ZID C27 H30 N8 O15 P2 c1cnccc1C(....
86 4U0K ic50 = 0.97 uM 744 C18 H23 Cl N2 O2 Cc1ccc(cc1....
87 4DRE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
88 4TRO Ki = 0.75 nM NAD ZID n/a n/a
89 2AQK Kd = 23 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
90 5G0V ic50 = 5.917 uM JDD C24 H28 N6 O2 CNC(=O)CN(....
91 5G0T ic50 = 0.057 uM S72 C29 H35 F N6 O3 Cc1c(nnn1C....
92 2NTV Ki = 11 nM P1H C30 H38 N8 O15 P2 CCCc1cc(cc....
93 4OXY Ki = 129 nM 1TN C18 H21 N O4 CCCCCCc1cc....
94 2IEB - ZID C27 H30 N8 O15 P2 c1cnccc1C(....
95 3FNE ic50 = 29 nM 8PC C18 H13 Cl2 N O2 c1ccnc(c1)....
96 2B35 Ki = 0.22 uM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
97 4TZT ic50 = 23.12 uM 468 C18 H23 Cl N2 O2 Cc1c(cccc1....
98 4OXN Ki = 40 nM 1S5 C19 H26 N2 O2 CCCCCCC1=C....
99 5CP8 Ki = 1570.6 nM TCU C19 H24 O2 CCCCCCc1cc....
100 3OEW Kd = 1.5 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
101 1D7O - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
102 1CWU - NAD TDB n/a n/a
103 1ENO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
104 4N5M - CAA C25 H40 N7 O18 P3 S CC(=O)CC(=....
105 4BO0 ic50 = 0.2 uM FXE C17 H18 N4 O3 Cn1c2cccc(....
106 4BNZ ic50 = 0.26 uM 8M5 C16 H14 N2 O Cn1cc(c2c1....
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 2AE2 - PTO C8 H15 N O CN1[C@H]2C....
114 2WYV - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
115 2WYW - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
116 1NFQ - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
117 3SJ7 Kd = 53.93 uM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
118 1X1T - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
119 2ZTV - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
120 1ZEM - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
121 3LT4 Ki = 0.1 uM FB4 C12 H9 Cl2 N O2 c1cc(c(cc1....
122 3AM4 ic50 = 97 nM FT1 C13 H8 Cl2 O3 c1cc(c(cc1....
123 2O2Y Ki = 0.4 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
124 1VRW - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
125 4IGE ic50 = 0.25 uM CHJ C16 H11 Cl O4 CC1=CC(=O)....
126 2OL4 ic50 = 440 nM JPN C21 H18 Cl2 O2 c1ccc(cc1)....
127 3LT0 Ki = 0.18 uM FT1 C13 H8 Cl2 O3 c1cc(c(cc1....
128 3AM5 Ki = 38 nM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
129 4IGF ic50 = 6 uM CHV C15 H9 Cl O5 c1cc2c(cc1....
130 1ZK1 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
131 4JP3 - CIT C6 H8 O7 C(C(=O)O)C....
132 2WSB - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
133 5CG1 - NAD BBN n/a n/a
134 5CG2 - NAD CJ3 n/a n/a
135 2Q2V - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
136 2Q2Q - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
137 3NUG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
138 1G0O Ki = 14 nM PYQ C11 H11 N O c1cc2c3c(c....
139 4ITU - 1HS C5 H12 O4 S2 C[C@@H](CS....
140 4RF2 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
141 1GCO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
142 5T2U - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
143 4NBU - CAA C25 H40 N7 O18 P3 S CC(=O)CC(=....
144 4KWH - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
145 4OSO - 2V4 C19 H14 O6 C[C@]1(Cc2....
146 5L4N ic50 = 57 uM 6QT C15 H12 O4 c1cc(cc(c1....
147 2EWM - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
148 3AI3 - SOE C6 H12 O6 C1[C@@H]([....
149 3AI2 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
150 4CR6 - MAN C6 H12 O6 C([C@@H]1[....
151 4ZA2 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
152 3OIG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
153 1AHH - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
154 3VDQ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
155 5B4V - DXX C4 H6 O4 CC(C(=O)O)....
156 5B4U - MLA C3 H4 O4 C(C(=O)O)C....
157 5FF9 ic50 = 5230 uM AEF C8 H11 N O c1cc(ccc1C....
158 4O1M - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
159 2DTE - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
160 3OID - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
161 2PD4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
162 2PD3 - TCL C12 H7 Cl3 O2 c1cc(c(cc1....
163 1EDO - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
164 2QIO ic50 = 3.6 uM TCL C12 H7 Cl3 O2 c1cc(c(cc1....
165 3OJF ic50 = 0.06 uM IMJ C23 H24 N4 O2 Cc1c(c2ccc....
166 4Q9N ic50 = 0.95 uM 0WE C22 H23 N3 O3 Cc1c2ccccc....
167 5THQ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
168 3QWF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
169 3AFN - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAD; Similar ligands found: 220
No: Ligand ECFP6 Tc MDL keys Tc
1 A3D 0.872727 0.986111
2 NAD IBO 0.845455 0.933333
3 NHD 0.821429 0.972222
4 NAP 0.811966 0.986111
5 NAJ PYZ 0.803419 0.910256
6 NFD 0.791304 0.946667
7 NXX 0.765766 0.972603
8 DND 0.765766 0.972603
9 ZID 0.737705 0.986111
10 NAQ 0.729508 0.934211
11 NAE 0.721311 0.959459
12 NA0 0.712 0.972603
13 TAP 0.704 0.921053
14 AMP NAD 0.696 0.945946
15 NDE 0.689922 0.972603
16 NAJ 0.683333 0.972222
17 NDC 0.679389 0.934211
18 NDO 0.674603 0.958904
19 N01 0.656 0.972222
20 CNA 0.642276 0.972603
21 NBP 0.621212 0.922078
22 NAD BBN 0.609929 0.876543
23 8ID 0.609756 0.922078
24 NAD CJ3 0.601399 0.845238
25 ADP MG 0.579439 0.918919
26 A2D 0.576923 0.958333
27 ADP 0.575472 0.931507
28 NGD 0.574803 0.922078
29 BEF ADP 0.574074 0.894737
30 ADP BEF 0.574074 0.894737
31 BA3 0.566038 0.958333
32 NAD NDT 0.565789 0.755319
33 M33 0.564815 0.918919
34 ADP PO3 0.563636 0.957747
35 B4P 0.560748 0.958333
36 AP5 0.560748 0.958333
37 ATP MG 0.558559 0.918919
38 AN2 0.555556 0.918919
39 GAP 0.553571 0.932432
40 OOB 0.551724 0.972222
41 CA0 0.550459 0.932432
42 ATP 0.545455 0.931507
43 ACP 0.545455 0.906667
44 NAD TDB 0.544872 0.70297
45 ADP ALF 0.54386 0.883117
46 ALF ADP 0.54386 0.883117
47 5FA 0.540541 0.931507
48 AQP 0.540541 0.931507
49 APR 0.540541 0.931507
50 AR6 0.540541 0.931507
51 ANP MG 0.53913 0.907895
52 VO4 ADP 0.53913 0.945205
53 ADP VO4 0.53913 0.945205
54 AGS 0.535714 0.883117
55 SAP 0.535714 0.883117
56 AD9 0.535714 0.906667
57 WAQ 0.533333 0.896104
58 ABM 0.53271 0.905405
59 00A 0.529412 0.921053
60 DLL 0.529412 0.972222
61 ANP 0.526316 0.906667
62 NJP 0.526316 0.959459
63 ACQ 0.526316 0.906667
64 OAD 0.525 0.932432
65 AMP MG 0.523364 0.905405
66 ADX 0.522523 0.839506
67 5AL 0.521739 0.945205
68 A1R 0.521008 0.871795
69 9SN 0.520325 0.909091
70 AMP 0.518868 0.930556
71 A 0.518868 0.930556
72 50T 0.517857 0.893333
73 ATF 0.517241 0.894737
74 DAL AMP 0.516949 0.945205
75 3OD 0.516393 0.932432
76 1ZZ 0.516393 0.851852
77 SON 0.513514 0.92
78 PRX 0.513274 0.881579
79 SRP 0.512821 0.92
80 ADP BMA 0.512397 0.932432
81 3UK 0.512397 0.958904
82 MYR AMP 0.512195 0.851852
83 NAJ PZO 0.510949 0.909091
84 NMN 0.509434 0.875
85 AMP DBH 0.507937 0.906667
86 A22 0.504202 0.945205
87 FA5 0.504 0.945946
88 ATP A A A 0.504 0.971831
89 TYR AMP 0.5 0.945946
90 8QN 0.5 0.945205
91 NAX 0.496183 0.886076
92 PR8 0.495935 0.8625
93 PAJ 0.495868 0.873418
94 4AD 0.495868 0.933333
95 AMO 0.495868 0.92
96 ADQ 0.495868 0.932432
97 A12 0.495495 0.894737
98 AP2 0.495495 0.894737
99 ALF ADP 3PG 0.492424 0.873418
100 LA8 ALF 3PG 0.492424 0.873418
101 AHZ 0.492308 0.851852
102 YAP 0.492063 0.933333
103 FYA 0.491935 0.918919
104 AHX 0.491803 0.884615
105 4UU 0.488372 0.933333
106 5SV 0.487603 0.8375
107 TAT 0.487179 0.894737
108 APC 0.486957 0.894737
109 SRA 0.486239 0.881579
110 NAI 0.484848 0.921053
111 6V0 0.484848 0.909091
112 GTA 0.484615 0.898734
113 A A 0.483871 0.958333
114 LAD 0.483871 0.873418
115 AU1 0.482456 0.906667
116 TXE 0.481203 0.921053
117 AF3 ADP 3PG 0.481203 0.873418
118 OMR 0.481203 0.841463
119 LAQ 0.480916 0.851852
120 G3A 0.48062 0.909091
121 TXA 0.48 0.92
122 NB8 0.48 0.884615
123 ME8 0.48 0.851852
124 BIS 0.48 0.871795
125 PTJ 0.48 0.884615
126 139 0.477941 0.886076
127 LPA AMP 0.477273 0.851852
128 AR6 AR6 0.476923 0.958333
129 G5P 0.476923 0.909091
130 AFH 0.476923 0.873418
131 25L 0.47619 0.945205
132 25A 0.47541 0.958333
133 DZD 0.47482 0.897436
134 TXD 0.473684 0.921053
135 4UV 0.472868 0.933333
136 TYM 0.470149 0.945946
137 ADV 0.470085 0.894737
138 RBY 0.470085 0.894737
139 ARG AMP 0.469697 0.841463
140 4TA 0.467626 0.864198
141 48N 0.466165 0.884615
142 XAH 0.465116 0.851852
143 4UW 0.462687 0.897436
144 M24 0.461538 0.886076
145 IOT 0.459854 0.821429
146 T5A 0.456522 0.853659
147 EAD 0.455782 0.886076
148 MAP 0.455285 0.883117
149 BT5 0.453901 0.821429
150 A4P 0.452555 0.833333
151 UP5 0.451852 0.933333
152 PAP 0.445378 0.917808
153 AP0 0.445255 0.884615
154 4TC 0.445255 0.909091
155 YLP 0.444444 0.831325
156 P1H 0.443709 0.864198
157 AOC 0.442478 0.810811
158 Z5A 0.439189 0.833333
159 2A5 0.436975 0.857143
160 G A A A 0.43662 0.909091
161 COD 0.43662 0.802326
162 ADJ 0.435714 0.841463
163 YLC 0.434783 0.851852
164 YLB 0.434783 0.831325
165 U A G G 0.433566 0.921053
166 ATR 0.433333 0.90411
167 7MD 0.432836 0.851852
168 G5A 0.429752 0.790698
169 PO4 PO4 A A A A PO4 0.429688 0.943662
170 TAD 0.42963 0.873418
171 5AS 0.42735 0.770115
172 BTX 0.426573 0.831325
173 YLA 0.425532 0.831325
174 DSZ 0.425197 0.790698
175 NCN 0.424779 0.805556
176 UPA 0.42446 0.921053
177 VMS 0.424 0.8
178 54H 0.424 0.8
179 N0B 0.422819 0.853659
180 6AD 0.422764 0.85
181 AYB 0.422535 0.821429
182 7D3 0.422414 0.844156
183 YLY 0.421769 0.821429
184 TSB 0.420635 0.809524
185 ODP 0.41958 0.922078
186 AV2 0.419355 0.855263
187 FB0 0.419355 0.775281
188 A5A 0.419355 0.819277
189 NNR 0.419048 0.739726
190 A A A 0.418605 0.918919
191 LEU LMS 0.418605 0.793103
192 649 0.417266 0.775281
193 NMN AMP PO4 0.416667 0.933333
194 SSA 0.416 0.790698
195 P5A 0.415385 0.755556
196 LSS 0.414062 0.772727
197 A2R 0.412698 0.918919
198 52H 0.412698 0.790698
199 JB6 0.412214 0.896104
200 5N5 0.411215 0.783784
201 YSA 0.410448 0.811765
202 5CA 0.409449 0.790698
203 53H 0.409449 0.790698
204 ITT 0.408333 0.878378
205 7D4 0.408333 0.844156
206 NA7 0.407692 0.894737
207 5CD 0.407407 0.794521
208 0WD 0.406897 0.909091
209 A3P 0.40678 0.930556
210 AVV 0.40625 0.860759
211 RAB 0.40566 0.808219
212 ADN 0.40566 0.808219
213 XYA 0.40566 0.808219
214 FDA 0.405063 0.823529
215 GSU 0.40458 0.790698
216 7MC 0.404255 0.831325
217 NSS 0.403101 0.811765
218 6FA 0.402516 0.853659
219 NVA LMS 0.4 0.793103
220 PPS 0.4 0.817073
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 2q2v.bio4) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: 691
This union binding pocket(no: 2) in the query (biounit: 2q2v.bio4) has 34 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1Y1A GSH 0.002554 0.5025 None
2 2QLX RM4 0.0008241 0.48936 None
3 1H8G CHT 0.006076 0.47946 None
4 1Y2W NAG 0.002091 0.4626 None
5 1C1L GAL BGC 0.005389 0.44954 None
6 4K30 NLG 0.003473 0.4404 None
7 3SJ0 DXC 0.02216 0.4194 None
8 1PTR PRB 0.03876 0.40733 None
9 3L0E G58 0.0008202 0.4066 None
10 2BO4 FLC 0.003356 0.45959 1.17647
11 3MAG 3MA 0.01814 0.44362 1.17647
12 4PNI KQQ 0.0002397 0.43035 1.17647
13 1IG3 VIB 0.0002176 0.41414 1.17647
14 3MAG SAH 0.002148 0.41319 1.17647
15 2QCX PF1 0.01845 0.41289 1.17647
16 4NM5 ADP 0.001973 0.40742 1.17647
17 4JEJ 1GP 0.002823 0.42918 1.22951
18 1EYQ NAR 0.0001267 0.49667 1.35135
19 3UEC ALA ARG TPO LYS 0.008839 0.43902 1.36986
20 2OFE NAG 0.02492 0.41167 1.40845
21 2PR5 FMN 0.001314 0.42469 1.51515
22 1QD0 RR6 0.007564 0.41186 1.5625
23 3SHR CMP 0.0006082 0.46163 1.56863
24 2BH9 NAP 0.00883 0.42172 1.56863
25 1JN2 SFP 0.002066 0.53722 1.68776
26 3S9K CIT 0.001284 0.54096 1.69492
27 1N9L FMN 0.006116 0.40043 1.83486
28 1DXY COI 0.0002891 0.53111 1.96078
29 1RPN NDP 0.000001449 0.50253 1.96078
30 2OWZ CIT 0.0007751 0.48291 1.96078
31 1RZM E4P 0.003906 0.45637 1.96078
32 1V6A TRE 0.006154 0.45215 1.96078
33 2WA4 069 0.001005 0.44729 1.96078
34 2C29 NAP 0.000007624 0.44719 1.96078
35 1I0Z OXM 0.0119 0.44597 1.96078
36 4HZO COA 0.002742 0.44494 1.96078
37 3P3N AKG 0.006224 0.44024 1.96078
38 2Q8M AMP 0.001666 0.43843 1.96078
39 1I0Z NAI 0.0004262 0.43839 1.96078
40 2C29 DQH 0.0000165 0.43674 1.96078
41 1RZM PEP 0.004486 0.43549 1.96078
42 4OB6 S2T 0.001259 0.43388 1.96078
43 1X87 NAD 0.002225 0.42826 1.96078
44 3O2K QRP 0.003976 0.42773 1.96078
45 2OWZ F6P 0.001447 0.42727 1.96078
46 2YDW WSH 0.004487 0.42555 1.96078
47 4PLG NAI 0.0003866 0.41711 1.96078
48 1F8G NAD 0.004841 0.41696 1.96078
49 3O2K DST 0.01532 0.41185 1.96078
50 1TV5 ORO 0.004324 0.41144 1.96078
51 3K37 BCZ 0.002112 0.41064 1.96078
52 3OJO NAD 0.005867 0.41041 1.96078
53 1L7E NAI 0.005063 0.41025 1.96078
54 1NHZ 486 0.00211 0.40644 1.96078
55 1Q8A HCS 0.04375 0.40527 1.96078
56 4PLG OXM 0.0003349 0.40518 1.96078
57 1DXY NAD 0.00547 0.40346 1.96078
58 1KYZ FER 0.0009307 0.40184 1.96078
59 1Y9Q MED 0.001142 0.47497 2.08333
60 1DBT U5P 0.0001314 0.46097 2.09205
61 3BRE C2E 0.006614 0.439 2.23464
62 1S8F GDP 0.0002714 0.42136 2.25989
63 2D3Y DU 0.02305 0.42683 2.28311
64 1EQ2 NAP 0.000004341 0.5144 2.35294
65 4WBD ADP 0.005518 0.44903 2.35294
66 4WBD CIT 0.007704 0.4486 2.35294
67 2F1K NAP 0.0004206 0.4482 2.35294
68 1NNS ASP 0.001559 0.44464 2.35294
69 4L7I SAM 0.0005942 0.44165 2.35294
70 1EZ4 NAD 0.001099 0.43146 2.35294
71 1H0C AOA 0.01289 0.43099 2.35294
72 1WDA BAG 0.006426 0.42366 2.35294
73 3PXP MYR 0.002211 0.42041 2.35294
74 3GE7 AFQ 0.00009648 0.41444 2.35294
75 1M5B BN1 0.0007831 0.41267 2.35294
76 3JQ3 ADP 0.009275 0.41241 2.35294
77 3OA2 NAD 0.002626 0.41083 2.35294
78 3TO7 COA 0.0002439 0.41023 2.35294
79 2I3G NAP 0.002134 0.40912 2.35294
80 4R5M NAP 0.002959 0.40881 2.35294
81 3A4T SFG 0.007954 0.40764 2.35294
82 1ZGA SAH 0.02306 0.40499 2.35294
83 2J5S KTA 0.004764 0.40437 2.35294
84 1FP1 SAH 0.02178 0.40291 2.35294
85 2YAB AMP 0.01776 0.40089 2.35294
86 1VL0 NAI 0.0000002551 0.58299 2.39726
87 1YRX FMN 0.0002075 0.46922 2.47934
88 2XVM SAH 0.01698 0.41152 2.51256
89 2X6T NAP 0.000002224 0.52548 2.52101
90 2YCD GTB 0.01066 0.40583 2.6087
91 1LOR BMP 0.0004228 0.40894 2.63158
92 3Q3C NAD 0.0004907 0.41526 2.67559
93 2FR6 CTN 0.001211 0.42597 2.73973
94 2FR6 URI 0.001229 0.42574 2.73973
95 3B1F NAD 0.00009183 0.49123 2.7451
96 2F2U M77 0.0003614 0.47102 2.7451
97 2Q8H TF4 0.005144 0.46522 2.7451
98 1CKM GTP 0.0008961 0.46031 2.7451
99 3CIF NAD 0.0002574 0.44997 2.7451
100 1GV0 NAD 0.00032 0.44313 2.7451
101 4KCT PYR 0.002699 0.43981 2.7451
102 4IMG NGF 0.0004107 0.43862 2.7451
103 3V91 UPG 0.0004546 0.42891 2.7451
104 1F3L SAH 0.0004991 0.42755 2.7451
105 1YS4 NAP 0.003633 0.42235 2.7451
106 4KCT FDP 0.004319 0.42171 2.7451
107 1BZL FAD 0.007946 0.42125 2.7451
108 4FBL SPD 0.02228 0.41682 2.7451
109 3L4S NAD 0.001279 0.41485 2.7451
110 1B8U NAD 0.006488 0.4145 2.7451
111 4G1V FAD 0.003071 0.41353 2.7451
112 2QV7 ADP 0.00485 0.41147 2.7451
113 1H65 GDP 0.002097 0.40997 2.7451
114 3L4S 3PG 0.001525 0.40954 2.7451
115 3TLJ SAH 0.01119 0.40122 2.7451
116 3CIF G3H 0.002095 0.40101 2.7451
117 1NYT NAP 0.007292 0.40099 2.7451
118 3DXY SAM 0.03348 0.40028 2.75229
119 4F8L GAL 0.01802 0.45215 2.75862
120 2HMT NAI 0.001159 0.44377 2.77778
121 3BY8 MLT 0.002049 0.47005 2.8169
122 2DT5 NAD 0.003639 0.40532 2.8436
123 3W8S GSH 0.0284 0.40426 2.91262
124 1MZV AMP 0.001719 0.44287 2.97872
125 2PVQ GSH 0.005546 0.40552 2.98507
126 1ZZ7 S0H 0.001744 0.45361 3.0303
127 1XIU REA 0.001213 0.43012 3.04348
128 1MXI SAH 0.0003519 0.44545 3.125
129 4M5P MLA 0.0007191 0.52085 3.13725
130 1A5Z NAD 0.00007041 0.4962 3.13725
131 1GPJ CIT 0.002401 0.45976 3.13725
132 4E13 NAD 0.0006748 0.45773 3.13725
133 1H16 PYR 0.005387 0.45649 3.13725
134 4M5P 23W 0.00614 0.4536 3.13725
135 4BG4 ARG 0.008385 0.44462 3.13725
136 1F1V DHY 0.002545 0.4409 3.13725
137 1MOQ GLP 0.0005118 0.43955 3.13725
138 1GUZ NAD 0.0005239 0.438 3.13725
139 2Z9V PXM 0.004806 0.43417 3.13725
140 1I9Z 2IP 0.01019 0.43363 3.13725
141 1KYQ NAD 0.004695 0.43103 3.13725
142 3A1I UNU 0.003529 0.42989 3.13725
143 1XX4 BAM 0.01109 0.42052 3.13725
144 3DG6 MUC 0.004237 0.41776 3.13725
145 1E5Q NDP 0.001822 0.41699 3.13725
146 3UDZ ADP 0.00993 0.41251 3.13725
147 1VDC FAD 0.0004574 0.4124 3.13725
148 1MUU NAD 0.00406 0.4114 3.13725
149 4DPL NAP 0.002524 0.4089 3.13725
150 3KB6 NAD 0.004111 0.40581 3.13725
151 4MP8 MLI 0.00006215 0.40574 3.13725
152 1B74 DGN 0.03026 0.42041 3.14961
153 4M4Q 21A 0.0007827 0.41383 3.3195
154 2VPR TDC 0.007964 0.40322 3.38164
155 4N7C AEF 0.005304 0.44987 3.40909
156 1F5F DHT 0.000788 0.43709 3.41463
157 2ORV 4TA 0.0005245 0.41942 3.4188
158 2OOR NAD 0.004825 0.41702 3.44828
159 3KO8 NAD 0.00000003021 0.58581 3.52941
160 3ULK NDP 0.000007165 0.48963 3.52941
161 1PEA ACM 0.002793 0.47096 3.52941
162 3B20 NAD 0.0003249 0.45985 3.52941
163 1O9U ADZ 0.006866 0.4586 3.52941
164 3B1J NAD 0.0001272 0.45842 3.52941
165 4JCA CIT 0.01102 0.45559 3.52941
166 1HDG NAD 0.00044 0.45083 3.52941
167 1W7J ADP BEF 0.000388 0.44855 3.52941
168 2C5A NAD 0.0000004735 0.44747 3.52941
169 1WRA PC 0.00869 0.43938 3.52941
170 2PZM NAD 0.00001941 0.43709 3.52941
171 3O7W SAM 0.006194 0.43296 3.52941
172 1O6Z NAD 0.002124 0.42595 3.52941
173 1EYE PMM 0.003439 0.42571 3.52941
174 3CEV ARG 0.006123 0.42456 3.52941
175 2RCN GDP 0.004768 0.42445 3.52941
176 4JWX 1N4 0.008207 0.42388 3.52941
177 4ZRN NAD 0.004557 0.41861 3.52941
178 1OC2 NAD 0.000005458 0.41368 3.52941
179 2NXW TPP 0.0001539 0.41204 3.52941
180 4GKV NAD 0.001476 0.40633 3.52941
181 1O0S NAI 0.007491 0.4059 3.52941
182 3VYW SAM 0.01022 0.40579 3.52941
183 3BW2 FMN 0.0001409 0.40412 3.52941
184 1EBF NAD 0.007645 0.40279 3.52941
185 3D2Y AH0 ALA FGA LYS 0.006273 0.40003 3.52941
186 3A2Y TS5 0.001778 0.42393 3.5533
187 2Q46 NAP 0.0000001695 0.57338 3.55731
188 1LSS NAD 0.006261 0.41518 3.57143
189 1QSC ACE TYR PRO ILE GLN GLU THR 0.02087 0.4038 3.66492
190 2O66 FLC 0.001975 0.45726 3.7037
191 4LN7 1ZQ 0.001444 0.4273 3.82775
192 4U9W COA 0.001127 0.43131 3.86473
193 4U9W SER GLY ARG GLY LYS NH2 0.02665 0.40786 3.86473
194 1ORR NAD 0.000000279 0.54548 3.92157
195 2HJR APR 0.00004243 0.50105 3.92157
196 2Q1S NAI 0.00001732 0.49449 3.92157
197 4CCO OGA 0.0003801 0.48282 3.92157
198 3ABI NAD 0.0001078 0.46118 3.92157
199 1CER NAD 0.0002049 0.46074 3.92157
200 4M51 BEZ 0.005859 0.45463 3.92157
201 1DSS NAD 0.0003899 0.45298 3.92157
202 3OCZ SRA 0.0004053 0.44784 3.92157
203 1GAD NAD 0.0006289 0.44119 3.92157
204 3H9E NAD 0.0006406 0.44087 3.92157
205 4C6F DOR 0.002239 0.43811 3.92157
206 4C6F NCD 0.002239 0.43811 3.92157
207 2PV7 NAD 0.0007807 0.4343 3.92157
208 3BAZ NAP 0.002005 0.42393 3.92157
209 4IHQ ADP 0.0075 0.42078 3.92157
210 3QV9 QV7 0.01438 0.41786 3.92157
211 1YBH FAD 0.002005 0.4159 3.92157
212 4E28 9MZ 0.02075 0.41546 3.92157
213 3ZF8 GDP 0.01124 0.40892 3.92157
214 2XCG XCG 0.00008433 0.40819 3.92157
215 2HIM ASN 0.03368 0.40757 3.92157
216 1MV8 NAD 0.004684 0.40617 3.92157
217 1LJ8 NAD 0.008977 0.40536 3.92157
218 1BW9 NAD 0.009287 0.40472 3.92157
219 2CKM AA7 0.0005398 0.40411 3.92157
220 4E28 0MZ 0.02895 0.40387 3.92157
221 4P4T GDP 0.004922 0.40386 3.92157
222 1SJD NPG 0.001797 0.40222 3.92157
223 3IAE D7K 0.0004932 0.40098 3.92157
224 2AQX ATP 0.01327 0.40079 3.92157
225 1LLU NAD 0.002153 0.40069 3.92157
226 1C1X NAD 0.006595 0.40019 3.92157
227 1VE3 SAM 0.00213 0.41708 3.96476
228 1UJ5 5RP 0.0318 0.40141 3.96476
229 1Y7P RIP 0.03821 0.41305 4.03587
230 2Y7P SAL 0.002169 0.44943 4.12844
231 1FW1 GSH 0.001558 0.43484 4.16667
232 3GX0 GDS 0.001146 0.42285 4.18605
233 3CF6 SP1 0.005715 0.40874 4.19162
234 2Y6P CTP 0.004449 0.42571 4.2735
235 1V7R CIT 0.01594 0.44674 4.30108
236 4R1S NAP 0.00000007137 0.59949 4.31373
237 2PK3 A2R 0.000001808 0.57695 4.31373
238 3LU1 NAD 0.0000001716 0.56793 4.31373
239 4W6Z ETF 0.0001802 0.54192 4.31373
240 3A4V NAD 0.0000001048 0.54173 4.31373
241 3U1T MLI 0.002317 0.46745 4.31373
242 2HFK E4H 0.001292 0.45937 4.31373
243 1SB8 NAD 0.000001236 0.45752 4.31373
244 3V1Y NAD 0.0003176 0.4531 4.31373
245 1UOU CMU 0.0005918 0.45135 4.31373
246 4DEC UDP 0.00002907 0.45115 4.31373
247 4DEC 3PG 0.00002907 0.45115 4.31373
248 1SB8 UD2 0.000001152 0.44482 4.31373
249 2WPB ZZI 0.0136 0.4326 4.31373
250 2R5T ANP 0.0005317 0.43055 4.31373
251 2G5C NAD 0.0008086 0.42777 4.31373
252 4KOA NDP 0.00712 0.42257 4.31373
253 2A2X NA9 0.001506 0.42254 4.31373
254 2FEQ 34P 0.002277 0.41993 4.31373
255 4I9B 1KA 0.02171 0.41982 4.31373
256 2VYN NAD 0.001998 0.41544 4.31373
257 3A4V PYR 0.006655 0.4081 4.31373
258 2GDJ ANP 0.02798 0.40779 4.31373
259 1GS5 ANP 0.0001937 0.40628 4.31373
260 1GS5 NLG 0.0001937 0.40628 4.31373
261 1G8S MET 0.04797 0.40375 4.34783
262 3GM5 CIT 0.003399 0.45264 4.40252
263 2WCI GSH 0.01798 0.41341 4.44444
264 4COQ SAN 0.0007601 0.4833 4.45344
265 3BRN SRO 0.03204 0.41407 4.4586
266 1B5E DCM 0.001863 0.4467 4.47154
267 3E5H GNP 0.0002896 0.42771 4.49438
268 2DC1 NAD 0.001008 0.42992 4.66102
269 1EJE FMN 0.0009795 0.42932 4.6875
270 1R6D NAD 0.000005073 0.5255 4.70588
271 1I2B UPG 0.0000002369 0.51524 4.70588
272 1I2B USQ 0.0000002369 0.51524 4.70588
273 1R6D DAU 0.00001474 0.50642 4.70588
274 3TKA CTN 0.01617 0.45609 4.70588
275 1Z44 NPO 0.03197 0.43765 4.70588
276 3DGB MUC 0.002192 0.43361 4.70588
277 4WVH ASP HIS ASP ALA HIS ALA 0.00391 0.43291 4.70588
278 2NCD ADP 0.006913 0.43242 4.70588
279 2B4R NAD 0.0005967 0.42991 4.70588
280 3SIX GDP 0.003663 0.4246 4.70588
281 1NVM NAD 0.0009918 0.42162 4.70588
282 2B4R AES 0.001461 0.41796 4.70588
283 3TKA SAM 0.001424 0.41578 4.70588
284 1Z41 FMN 0.004122 0.41417 4.70588
285 1Y42 TYR 0.01476 0.41257 4.70588
286 4Q3S X7A 0.001031 0.41167 4.70588
287 1I2B NAD 0.00001601 0.40959 4.70588
288 2B6N ALA PRO THR 0.03843 0.40537 4.70588
289 2WUF KEM 0.002092 0.40327 4.70588
290 1P31 EPU 0.01586 0.40316 4.70588
291 3LGS SAH 0.0303 0.40247 4.70588
292 1Z48 FMN 0.009059 0.40107 4.70588
293 1HDO NAP 0.000004741 0.49561 4.85437
294 2R09 4IP 0.03376 0.41123 4.89914
295 2BKA NDP 0.0000004212 0.55804 4.95868
296 1UW1 ADP 0.01061 0.42392 5
297 2RNF UM3 0.04978 0.40261 5
298 2EB5 OXL 0.00003629 0.54553 5.09804
299 3WMX NAD 0.000006766 0.52017 5.09804
300 1LTH NAD 0.0001703 0.47151 5.09804
301 1PX8 XYP 0.001877 0.45826 5.09804
302 2C7G ODP 0.0000251 0.45527 5.09804
303 3ICS ADP 0.003972 0.44668 5.09804
304 3MD0 GDP 0.00238 0.44215 5.09804
305 2ZJ5 ADP 0.004933 0.43912 5.09804
306 4C2G ALA ALA ALA ALA 0.003156 0.4369 5.09804
307 2JC9 ADN 0.006621 0.42801 5.09804
308 3F3E LEU 0.00005924 0.42594 5.09804
309 3ICT ADP 0.01123 0.42414 5.09804
310 1UF5 CDT 0.006103 0.41999 5.09804
311 1OYB FMN 0.0006763 0.41941 5.09804
312 1E5F PLP 0.003099 0.41892 5.09804
313 1N7G GDR 0.000004804 0.41873 5.09804
314 2YFT DQR 0.004027 0.41456 5.09804
315 1OYB HBA 0.0004758 0.41387 5.09804
316 3I51 45C 0.007288 0.41251 5.09804
317 1YHM AHD 0.02749 0.40491 5.09804
318 1UCN ADP 0.004339 0.41736 5.26316
319 2QTR NXX 0.00003292 0.43404 5.29101
320 1JH7 UVC 0.02822 0.40438 5.29101
321 2JBH 5GP 0.000227 0.48583 5.33333
322 2FH5 GTP 0.001904 0.41505 5.40541
323 3NOJ PYR 0.02572 0.40399 5.46218
324 3E81 SLB 0.009806 0.42548 5.4878
325 3KJQ B94 0.004393 0.42141 5.4878
326 1V35 NAI 0.000000198 0.50548 5.4902
327 4NAO AKG 0.004343 0.45412 5.4902
328 2C5S AMP 0.001946 0.44589 5.4902
329 2FOI JPA 0.003551 0.42978 5.4902
330 3FPZ AHZ 0.0006797 0.42731 5.4902
331 4DYO SD4 0.005616 0.42617 5.4902
332 1CBF SAH 0.003036 0.41926 5.4902
333 3EE4 MYR 0.00117 0.41872 5.4902
334 3DAG FEG 0.00001813 0.41578 5.4902
335 1RHC F42 ACN 0.0002071 0.41476 5.4902
336 2CDU ADP 0.01265 0.41088 5.4902
337 2R0D 4IP 0.0377 0.40861 5.4902
338 3MB5 SAM 0.007071 0.40697 5.4902
339 1WNG SAH 0.003724 0.40473 5.4902
340 2B3B GLC 0.03915 0.40385 5.4902
341 1RM4 NDP 0.0008864 0.40168 5.4902
342 2PTR 2SA 0.001258 0.40089 5.4902
343 1SBR VIB 0.04388 0.40501 5.5
344 2Q37 3AL 0.0005233 0.48354 5.52486
345 1B4P GPS 0.001915 0.41875 5.52995
346 1EJ0 SAM 0.005066 0.42591 5.55556
347 1LYX PGA 0.000348 0.46041 5.64516
348 2IYG FMN 0.001967 0.43551 5.64516
349 4MUS LY0 0.02393 0.4113 5.6872
350 1L3I SAH 0.0002493 0.42249 5.72917
351 2F59 INI 0.001416 0.42351 5.73248
352 2YGO PCF 0.0004075 0.40941 5.85106
353 4B9E FAH 0.00007185 0.54105 5.88235
354 2ZWS PLM 0.0007972 0.53026 5.88235
355 2YY7 NAD 0.000002399 0.51985 5.88235
356 3NFZ 3NF 0.001099 0.44573 5.88235
357 1WNB BTL 0.007002 0.43797 5.88235
358 3GJB AKG 0.006567 0.42326 5.88235
359 1C7S CBS 0.004982 0.4192 5.88235
360 1X14 NAD 0.009074 0.41764 5.88235
361 3V1V GST 0.002703 0.41715 5.88235
362 2O2C G6Q 0.004098 0.41427 5.88235
363 4II2 ATP 0.0102 0.40583 5.88235
364 1XE7 GUN 0.004057 0.47066 5.91133
365 1Y75 NAG 0.002712 0.43972 5.9322
366 4L6C 0BT 0.001775 0.40897 5.94059
367 2RI1 GLP 0.03169 0.40892 5.95745
368 2DBZ NAP 0.003131 0.40786 5.98802
369 3EJ0 11X 0.005579 0.43394 6.12245
370 1JAY NAP 0.01064 0.40217 6.13208
371 4EXO PYR 0.001001 0.49353 6.16438
372 1DEK DGP 0.04647 0.40599 6.22407
373 2W3L DRO 0.02564 0.42825 6.25
374 1GY8 NAD 0.000002116 0.5219 6.27451
375 2Q1A 2KT 0.0004599 0.49358 6.27451
376 2XDQ MGX 0.005832 0.46234 6.27451
377 2VAR KDG 0.0006535 0.45484 6.27451
378 3PLN U5P 0.001914 0.45183 6.27451
379 2VAR KDF 0.001313 0.44261 6.27451
380 1PL6 NAD 0.001557 0.44178 6.27451
381 2EXX NAP 0.0001758 0.43951 6.27451
382 1K6M AGS 0.0004597 0.42875 6.27451
383 1XVA SAM 0.0007989 0.4284 6.27451
384 2WK1 SAH 0.0006657 0.42718 6.27451
385 2VAR AMP 0.007478 0.41631 6.27451
386 2VUT NAD 0.005912 0.41628 6.27451
387 2OG2 MLI 0.03691 0.41394 6.27451
388 2GJN NIS 0.0003894 0.41321 6.27451
389 2GJN FMN 0.0007385 0.41126 6.27451
390 2VAR ANP 0.003226 0.40351 6.27451
391 4OBW SAM 0.01793 0.4007 6.27451
392 3QDY CBS 0.001788 0.47295 6.29371
393 3QDT A2G GAL 0.004784 0.4591 6.29371
394 3QDY A2G GAL 0.008066 0.44758 6.29371
395 1ECM TSA 0.001889 0.44645 6.42202
396 2JAR UMP 0.002172 0.41677 6.5
397 2DWU DGL 0.001857 0.44677 6.52174
398 3F81 STT 0.001163 0.49927 6.55738
399 2BNF UTP 0.0004308 0.40338 6.639
400 2GWD GLU 0.0008502 0.46129 6.66667
401 2VKL MLT 0.03111 0.43059 6.66667
402 3HAZ FAD 0.00005713 0.42731 6.66667
403 1WDK NAD 0.002367 0.42712 6.66667
404 1LDN NAD 0.0003766 0.42587 6.66667
405 2IXB NAD 0.001216 0.4183 6.66667
406 3HAZ NAD 0.0003443 0.40841 6.66667
407 1T0I FMN 0.002177 0.41673 6.80628
408 3RF4 FUN 0.0006052 0.4739 6.89655
409 1YOA FMN 0.002162 0.50532 6.91824
410 1YOA FAD 0.0003327 0.43348 6.91824
411 2JGS BTN 0.01354 0.4166 6.92308
412 1ZJ6 G3D 0.003681 0.42451 6.95187
413 2IZ1 ATR 0.0008316 0.48147 7.05882
414 1HYE NAP 0.000521 0.45496 7.05882
415 1UXG FUM 0.00001386 0.44479 7.05882
416 3VPH NAD 0.0002295 0.43946 7.05882
417 3AYS CT3 0.002872 0.43361 7.05882
418 1RYI GOA 0.04722 0.43082 7.05882
419 3DER ALA LYS 0.0005691 0.42953 7.05882
420 3WBF API 0.00003586 0.42602 7.05882
421 1UXG NAD 0.0001789 0.42261 7.05882
422 3KMZ EQO 0.0003899 0.41652 7.05882
423 3VPH OXM 0.001574 0.40189 7.05882
424 1QO0 BMD 0.0115 0.42763 7.14286
425 2FR1 NDP 0.00000002426 0.58933 7.20165
426 1SC3 MLI 0.005785 0.45492 7.30337
427 1ULE GLA GAL NAG 0.00151 0.4845 7.33333
428 2WEL K88 0.01899 0.42613 7.33333
429 1L6O SER LEU LYS LEU MET THR THR VAL 0.02073 0.40395 7.36842
430 3EW2 BTN 0.002514 0.44113 7.40741
431 4EUE NAI 0.0000001398 0.56123 7.45098
432 4PIV NDP 0.0000006864 0.54025 7.45098
433 1EB9 HBA 0.0001892 0.47657 7.45098
434 1SQ5 PAU 0.003265 0.44159 7.45098
435 2YIV YIV 0.0141 0.43524 7.45098
436 3OND ADN 0.00008541 0.43349 7.45098
437 2YIV NBN 0.0115 0.43342 7.45098
438 1SQ5 ADP 0.002938 0.42848 7.45098
439 1OGD RIP 0.01007 0.41995 7.63359
440 1FHX 4IP 0.0193 0.41611 7.75194
441 1E7S NAP 0.0000001116 0.56484 7.84314
442 3SQG COM 0.00596 0.47032 7.84314
443 1Q11 TYE 0.0008756 0.46682 7.84314
444 1T26 GBD 0.0001403 0.45635 7.84314
445 3K3G MMU 0.005515 0.43417 7.84314
446 3SQG TP7 0.002296 0.4239 7.84314
447 2Y7G AAE 0.007576 0.40405 7.84314
448 1RJD SAM 0.01334 0.40068 7.84314
449 1XX6 ADP 0.01218 0.40747 7.8534
450 3W6G FLC 0.04898 0.40239 7.87037
451 2YLD CMO 0.0004405 0.49447 7.87402
452 1M9H NAD 0.0008511 0.40301 7.91367
453 3RK0 AMP 0.001111 0.44554 8.01688
454 2HVK TBA 0.0373 0.40329 8.01887
455 1FQK ALF 0.04907 0.40349 8.16327
456 1NXJ GLV 0.006963 0.42216 8.19672
457 1NXJ TLA 0.00787 0.4016 8.19672
458 1RKX NAD 0.00000006249 0.57932 8.23529
459 3H8V ATP 0.0004132 0.47568 8.23529
460 2QF7 COA 0.0007157 0.44811 8.23529
461 3TFC PEP 0.00385 0.43842 8.23529
462 1P1M MET 0.0003242 0.43386 8.23529
463 1I36 NAP 0.002653 0.42502 8.23529
464 4P53 NAI 0.000167 0.42425 8.23529
465 2OAT PFM 0.00403 0.41069 8.23529
466 1X7D NAD 0.003813 0.40454 8.23529
467 3G89 SAM 0.02561 0.40275 8.43373
468 4M1U A2G MBG 0.00333 0.45798 8.57143
469 2Q1W NAD 0.000001782 0.52038 8.62745
470 4LIT AKG 0.0008294 0.47443 8.62745
471 3CQ5 PMP 0.005533 0.42645 8.62745
472 3JV7 NAD 0.002127 0.41173 8.62745
473 1GU3 BGC BGC BGC BGC BGC 0.003042 0.44295 8.72483
474 1Q6O LG6 0.0001466 0.46956 8.7963
475 2WMO GTP 0.008038 0.40682 8.94737
476 1GJW GLC 0.002311 0.4675 9.01961
477 1GJW MAL 0.001174 0.44977 9.01961
478 3L6R MLI 0.009092 0.43842 9.01961
479 2VT3 ATP 0.01254 0.42174 9.30233
480 1E4E ADP 0.0001698 0.45693 9.41177
481 4RJK PYR 0.005645 0.45546 9.41177
482 1E4E PHY 0.0005278 0.44831 9.41177
483 1HYH NAD 0.0009887 0.42167 9.41177
484 1ZQ9 SAM 0.006463 0.42106 9.41177
485 4K28 NAD 0.002871 0.41756 9.41177
486 4RJK TDL 0.0002199 0.41401 9.41177
487 4RJK TPP 0.0008183 0.40352 9.41177
488 4L8V NAP 0.003923 0.40158 9.41177
489 1Q3Q ANP 0.007226 0.40115 9.41177
490 4PVD NDP 0.000000303 0.57429 9.80392
491 3ZPG 5GP 0.00251 0.48166 9.80392
492 3P7I P7I 0.001263 0.45981 9.80392
493 2GZ3 NAP 0.001371 0.40759 9.80392
494 2NU8 COA 0.006007 0.40182 9.80392
495 1GXU 2HP 0.03147 0.40371 9.89011
496 3R51 MMA 0.00008614 0.55881 10
497 2FYU FDN 0.003945 0.40735 10
498 3MTW M3R 0.0008221 0.44095 10.1961
499 5MDH NAD 0.001808 0.4199 10.1961
500 4OOE NDP 0.002245 0.41901 10.1961
501 1WP4 NDP 0.002573 0.41385 10.1961
502 4MDH NAD 0.003008 0.41117 10.1961
503 1SQF SAM 0.01176 0.40913 10.1961
504 1QDS PGA 0.002396 0.43688 10.3586
505 4AML GYU 0.02503 0.41919 10.5263
506 4F4S EFO 0.01361 0.41414 10.5263
507 4Q0A 4OA 0.0002734 0.44943 10.5882
508 1LDM NAD 0.000458 0.43719 10.5882
509 1Y1P NMN AMP PO4 0.01973 0.41397 10.5882
510 1PZG A3D 0.0004714 0.41271 10.5882
511 1U29 I3P 0.01279 0.43403 10.8527
512 3QV1 NAD 0.002311 0.4185 10.9756
513 1BXK NAD 0.0000007149 0.54913 10.9804
514 3I0O ADP 0.00612 0.41994 10.9804
515 3I0O SMI 0.02314 0.40837 10.9804
516 3HF3 FMN 0.003388 0.40277 10.9804
517 4PTZ FMN 0.004885 0.40757 10.9948
518 2W9S TOP 0.04788 0.40352 11.1801
519 2BZ1 TAU 0.001629 0.5124 11.2245
520 3VPQ GSH 0.01584 0.42425 11.2745
521 3MJE NDP 0.0000000006095 0.66139 11.2903
522 2P8O BVA 0.0005743 0.44221 11.3402
523 1NU4 MLA 0.03278 0.42933 11.3402
524 2B7N NTM 0.01362 0.41895 11.3725
525 4N02 FNR 0.0004758 0.41566 11.3725
526 4NTX AMR 0.02882 0.40175 11.6667
527 1TH8 ADP 0.0124 0.40714 11.7241
528 4WB7 ATP 0.008163 0.40851 11.7647
529 1OUW MLT 0.008108 0.4192 11.8421
530 2E1A MSE 0.002042 0.445 12
531 3QP4 HL0 0.007894 0.40336 12.0879
532 2JL1 NAP 0.0002447 0.47288 12.1569
533 1T10 F6P 0.007505 0.43079 12.1569
534 1KEW TYD 0.000005754 0.42803 12.1569
535 2RHQ GAX 0.0007283 0.42201 12.1569
536 1KEW NAD 0.00001284 0.41675 12.1569
537 2YYJ 4HP 0.003509 0.406 12.1569
538 2YYJ FAD 0.003509 0.406 12.1569
539 3PMD 11A 0.006072 0.42008 12.4183
540 1WVG APR 0.0000004498 0.57293 12.549
541 3IU9 T07 0.0003184 0.42518 12.549
542 1KBI PYR 0.0003569 0.4177 12.549
543 1KBI FMN 0.0003569 0.4177 12.549
544 2A92 NAI 0.0009572 0.41951 12.9412
545 1LUA NAP 0.009648 0.4069 12.9412
546 4GLL NAD 0.0000002238 0.55367 13.3333
547 2JFV FLC 0.003925 0.44969 13.3333
548 9LDB NAD 0.0001869 0.44884 13.3333
549 9LDT NAD 0.0001902 0.44856 13.3333
550 3LTW HLZ 0.005505 0.44276 13.3333
551 1SS4 CIT 0.01022 0.47056 13.7255
552 2Q09 DI6 0.001387 0.4522 13.7255
553 1SS4 GSH 0.02436 0.45163 13.7255
554 1TUV VK3 0.003143 0.47651 14.0351
555 2BOI MFU 0.007007 0.42692 14.1593
556 2F01 BTN 0.002541 0.40243 14.1732
557 2F01 BTQ 0.002745 0.40141 14.1732
558 3KMT SAH 0.006227 0.41119 14.2857
559 4NAT ADP 0.001356 0.41905 14.375
560 4NAT 2W5 0.0003201 0.40572 14.375
561 1LNX URI 0.01793 0.40882 14.8148
562 4LHM AZZ 0.003782 0.44438 15.2941
563 4G4S LDZ 0.006348 0.40333 15.3153
564 1EP2 ORO 0.0002945 0.40277 15.6863
565 2V5E SCR 0.003665 0.48196 15.8416
566 1SOW NAD 0.0002456 0.44135 16.0784
567 2HYQ MAN MAN 0.04172 0.40034 16.3934
568 2V6G NAP 0.0000004756 0.54623 16.4706
569 2DFV NAD 0.002195 0.41658 16.4706
570 1FQJ ALF 0.04083 0.40914 16.6667
571 2NVK NAP 0.001004 0.4642 16.8627
572 1EK6 UPG 0.000008359 0.41044 16.8627
573 4HXY NDP 0.000000000833 0.64972 16.895
574 4HXY ACA 0.006438 0.42237 16.895
575 1FK8 NAD 0.000000000004151 0.77849 17.2549
576 5RHN 8BR 0.002208 0.42455 17.3913
577 1Q3P GLU ALA GLN THR ARG LEU 0.0006337 0.46675 17.4312
578 4WNB 4BN 0.02116 0.40037 17.8295
579 3I6I NDP 0.0001306 0.42824 18.4314
580 4G28 0W8 0.004297 0.43116 18.6275
581 3ORF NAD 0.0000004623 0.55648 19.5219
582 4TQG NDP 0.00000003837 0.59841 19.6078
583 2GJ3 FAD 0.0001559 0.40366 20
584 1UO5 PIH 0.04183 0.43081 20.5882
585 2Y69 CHD 0.03753 0.40398 20.6349
586 2HK9 ATR 0.005859 0.44263 20.7843
587 2NZ2 ASP 0.01365 0.41408 21.9608
588 2D2I NAP 0.0003545 0.45828 23.1373
589 1Z45 NAD 0.0000002511 0.56162 23.5294
590 1YB5 NAP 0.0009684 0.41285 23.9216
591 1UDB NAD 0.000003498 0.43216 24.3137
592 1UDB UFG 0.0000006267 0.40778 24.3137
593 3GFB NAD 0.004573 0.40398 24.7059
594 3RFV NAI 0.000001461 0.5419 25.098
595 3RFV 15L 0.00004525 0.48706 25.098
596 4J1Q NDP 0.00000001714 0.56497 26.6667
597 3O26 NDP 0.000000000002745 0.70594 31.3725
598 1T0S BML 0.001571 0.48362 31.3953
599 1SNY NAP 0.000000001618 0.66547 31.7647
600 3RJ5 NAD 0.00000000001944 0.65016 32.2835
601 1OAA OAA 0.00000000003854 0.60023 32.549
602 1XSE NDP 0.00000000003645 0.62248 33.3333
603 2BD0 NAP 0.0000000000001698 0.77979 33.6066
604 3TN7 NJP 0.0000000000006457 0.76649 33.7255
605 1BDB NAD 0.0000000002722 0.65498 33.7255
606 3ZV6 NAD 0.00000000006395 0.60859 34.5098
607 3ZV6 4HB 0.0000000000724 0.59978 34.5098
608 1Z6Z NAP 0.00000000005901 0.70008 34.902
609 4K26 NDP 0.0000000000397 0.69934 35.2941
610 4K26 SFF 0.000000000468 0.59574 35.2941
611 1A27 NAP 0.00000000009983 0.69137 35.6863
612 3HB5 NAP 0.0000000007307 0.53815 35.6863
613 3CH6 311 0.0000000005647 0.48701 35.6863
614 3HB5 E2B 0.0005875 0.41783 35.6863
615 1A27 EST 0.004643 0.41219 35.6863
616 1W8D NAP 0.00000000009572 0.73125 35.7616
617 1W73 NAP 0.0000000001737 0.7205 35.7616
618 2JAH NDP 0.000000000001078 0.75814 37.247
619 2JAP NDP 0.000000000001109 0.75768 38.0567
620 1N5D NDP 0.00000000005955 0.69273 38.4314
621 1WMA AB3 0.0000000001969 0.57985 38.4314
622 1WMA NDP 0.0007631 0.4291 38.4314
623 3WXB NDP 0.0001737 0.48424 38.8235
624 1MXH DHF 0.00000002764 0.54782 39.8551
625 1MXH NAP 0.00000003722 0.54407 39.8551
626 2GDZ NAD 0.00000000000002953 0.82603 40
627 1U7T NAD 0.000000000006132 0.754 40.3922
628 1U7T TDT 0.00000000001591 0.62832 40.3922
629 4IXW IXW 0.003583 0.43454 40.9449
630 1O5I NAD 0.00000002117 0.66346 40.9639
631 3GEG NAD 0.000000000001889 0.77417 41.2955
632 3RKR NAP 0.0000001125 0.68299 41.9608
633 4FC7 NAP 0.0000000007462 0.56993 42.3529
634 2DKN NAI 0.00000000000001976 0.84232 43.1373
635 1XG5 NAP 0.000000000003233 0.74023 43.1373
636 1UAY ADN 0.000001946 0.6035 43.3884
637 1W6U NAP 0.0000000001903 0.71885 43.5294
638 3BMQ NAP 0.0000000003515 0.67051 43.5294
639 3JQ8 NAP 0.0000000003911 0.66875 43.5294
640 3BMN NAP 0.0000000004075 0.66806 43.5294
641 3BMO NAP 0.0000000006403 0.66736 43.5294
642 3JQA NAP 0.000000001035 0.66614 43.5294
643 3JQF NAP 0.0000000004602 0.66605 43.5294
644 2WD7 NAP 0.0000000008365 0.66285 43.5294
645 3JQ9 NAP 0.0000000005955 0.66178 43.5294
646 3JQG NAP 0.000000001666 0.65798 43.5294
647 3JQB NAP 0.000000001828 0.6564 43.5294
648 4CLO NAP 0.0001002 0.50463 43.5294
649 5JCJ NAP 0.0001279 0.49649 43.5294
650 4CM4 NAP 0.0001341 0.49561 43.5294
651 5JDC NAP 0.0001355 0.49542 43.5294
652 4CM8 NAP 0.0001408 0.4947 43.5294
653 4CMI NAP 0.0001639 0.49188 43.5294
654 4CME NAP 0.0001641 0.49186 43.5294
655 3JQ7 NAP 0.0003059 0.48358 43.5294
656 1H5Q NAP 0.000000000002541 0.74416 43.9216
657 3U4C NDP 0.0000000007765 0.66411 43.9216
658 1E3W NAD 0.0000000000002739 0.78911 44.3137
659 1E6W NAD 0.000000000001034 0.7671 44.3137
660 3QWI NAP 0.000000000001079 0.75011 44.3137
661 2BGM NAJ 0.00000000007854 0.71819 44.3137
662 3QWI CUE 0.000000000005877 0.63908 44.3137
663 1XHL NDP 0.0000000000004533 0.74863 45.098
664 1G0N PHH 0.000000000001632 0.75599 45.4902
665 1G0N NDP 0.000000000001084 0.75551 45.4902
666 1YXM ADE 0.0001134 0.54293 45.4902
667 3ICC NAP 0.0000000000000705 0.79387 45.8824
668 2ZAT NAP 0.000000000009379 0.73056 45.8824
669 4O0L NDP 0.000000000003946 0.73698 46.2745
670 3V1U NAD 0.00000000001432 0.75653 46.6667
671 3VZS NAP 0.0000000003479 0.56864 46.6667
672 1XKQ NDP 0.0000000000007813 0.74743 47.0588
673 1PR9 NAP 0.0000000000005657 0.75253 47.541
674 3D3W NAP 0.000000000001521 0.75252 47.541
675 4QED NAP 0.0000000001249 0.68766 47.5806
676 4OSP NAP 0.00000000000005351 0.82553 47.8431
677 1AE1 NAP 0.0000000000002577 0.76495 47.8431
678 4KWI NAP 0.000000000004074 0.65021 47.8431
679 4KWI 1TJ 0.000000000004675 0.63987 47.8431
680 4OSP 2V4 0.04881 0.40247 47.8431
681 4CQM NAP 0.0000000000003849 0.78347 48.2353
682 1JA9 NDP 0.000000000002037 0.73991 48.2353
683 1JA9 PYQ 0.005195 0.45002 48.2353
684 4FN4 NAD 0.0000000000002225 0.79256 48.4252
685 1GEE NAD 0.0000000000003418 0.78544 48.6275
686 1GEG NAD 0.0000000000001231 0.80236 49.0196
687 1ZBQ NAD 0.00000000002824 0.69773 49.0196
688 1GZ6 NAI 0.0000000001824 0.67448 49.0196
689 3A28 NAD 0.0000000000004197 0.78204 49.8039
690 3AY6 NAI 0.0000000000002756 0.71715 49.8039
691 3AY6 BGC 0.000000000001675 0.59565 49.8039
Pocket No.: 3; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 2q2v.bio2) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: 64
This union binding pocket(no: 4) in the query (biounit: 2q2v.bio2) has 34 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4YGM URA 0.03658 0.40158 1.2931
2 1E1M FAD 0.007405 0.40228 1.56863
3 5KO1 6UY 0.02141 0.40327 1.96078
4 4RF7 ARG 0.009144 0.43789 2.35294
5 4YCA NDP 0.00152 0.42581 2.7451
6 5KKA 6V0 0.0004871 0.42469 2.7451
7 5L8L ADP 0.03865 0.40052 3.13725
8 2PZM UDP 0.00001941 0.49261 3.52941
9 2C5A GDC 0.0000004735 0.44747 3.52941
10 4ZRN UPG 0.000003154 0.44053 3.52941
11 4RDH AMP 0.004046 0.43791 3.52941
12 5JE8 NAD 0.002274 0.42169 3.52941
13 1OC2 TDX 0.000005458 0.41368 3.52941
14 4RLQ 3SK 0.04257 0.40573 3.52941
15 4D79 ATP 0.001149 0.45539 3.62319
16 1UWK NAD 0.00111 0.42808 3.92157
17 5T9F TYR 0.0006774 0.42748 3.92157
18 5T9F NAP 0.000917 0.4214 3.92157
19 1J0X NAD 0.003022 0.40961 3.92157
20 5KAX RHQ 0.04695 0.4034 4.21687
21 3GGO ENO 0.0007276 0.43091 4.31373
22 5JCM FAD 0.01039 0.40265 4.31373
23 5JCM ISD 0.01077 0.40265 4.31373
24 5JCM NAD 0.01077 0.40265 4.31373
25 5FQD LVY 0.02033 0.41121 4.70588
26 3C0G 3AM 0.03249 0.40094 5.09804
27 4XZ3 COA 0.009277 0.40196 5.65217
28 5A0U CHT 0.03031 0.41378 5.88235
29 5WGG SAM 0.0183 0.40655 5.88235
30 5IN4 6CK 0.00004451 0.53811 6.27451
31 5IN4 NAP 0.00004542 0.53811 6.27451
32 5IN4 GDP 0.00004582 0.53677 6.27451
33 5MSO NAP 0.0000002222 0.52306 6.66667
34 5AVF TAU 0.0378 0.40466 6.66667
35 4U7W NDP 0.00000003681 0.5542 7.45098
36 5JAQ NAI 0.000002755 0.51902 7.45098
37 5CAE COA 0.00365 0.41617 7.45098
38 5LD5 NAD 0.0006226 0.45168 7.84314
39 5E8J SAH 0.01651 0.41213 9.09091
40 5AYV NAP 0.0004137 0.40351 9.41177
41 5F5N NAD 0.0000021 0.4913 10.7266
42 5UAV TFB 0.001224 0.41678 11.7647
43 5UAV NDP 0.001224 0.41678 11.7647
44 5L4L NAP 0.000001658 0.48644 16.0784
45 5L4L 7OX 0.00004437 0.47129 16.0784
46 1EK6 NAI 0.000002529 0.43073 16.8627
47 5L53 NAP 0.0000000006312 0.57224 18.4314
48 5L4S 6KX 0.00000000003445 0.69741 19.6078
49 5L4S NAP 0.00000000003445 0.69741 19.6078
50 5GT9 NAP 0.00000000003814 0.67458 32.9412
51 4J7U YTZ 0.0000000003091 0.67233 34.902
52 4J7U NAP 0.0000000003091 0.67233 34.902
53 3CH6 NAP 0.0000000005647 0.68943 35.6863
54 4FC7 COA 0.0000000007462 0.6579 42.3529
55 4YAG NAI 0.00000000001408 0.72294 43.1373
56 3H4V DVP 0.000000001095 0.65161 43.1373
57 3H4V NAP 0.000000004338 0.62728 43.1373
58 5K6A NAP 0.0000000002211 0.64036 43.5294
59 4CM9 NAP 0.000000000236 0.63939 43.5294
60 4CLR NAP 0.0000000006537 0.61818 43.5294
61 5JDI NAP 0.0000000006595 0.61811 43.5294
62 5JCJ 6JM 0.02186 0.42147 43.5294
63 5EPO NAP 0.0000000001015 0.65115 46.2745
64 3VZS CAA 0.000000003887 0.4626 46.6667
Pocket No.: 5; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 2q2v.bio3) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 2q2v.bio3) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: 19
This union binding pocket(no: 7) in the query (biounit: 2q2v.bio3) has 35 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2IOR ADP 0.04577 0.40503 0.851064
2 4LZB URA 0.0314 0.41158 1.2605
3 1V59 NAD 0.02384 0.4088 2.35294
4 4N49 SAM 0.008964 0.40945 2.7451
5 1FEC FAD 0.003202 0.40919 2.7451
6 2PUZ NIG 0.04885 0.40347 3.13725
7 2WH8 II2 0.04582 0.40123 3.52941
8 1UWK URO 0.001178 0.42461 3.92157
9 1OIJ AKG 0.02847 0.4164 3.92157
10 3GGO NAI 0.0007795 0.4272 4.31373
11 2WPF WPF 0.01604 0.40613 5.4902
12 2WPF FAD 0.01565 0.40613 5.4902
13 3CMC NAD 0.00131 0.4375 7.05882
14 5VE5 GSH 0.02211 0.41641 7.05882
15 1ZGS XMM 0.005919 0.46123 8.23529
16 5FBK TCR 0.04566 0.40509 8.23529
17 4K91 SIN 0.03918 0.41295 8.62745
18 3QVP FAD 0.004096 0.40242 8.62745
19 1JNR FAD 0.01346 0.40148 10
Pocket No.: 8; Query (leader) PDB : 2Q2V; Ligand: NAD; Similar sites found: 84
This union binding pocket(no: 8) in the query (biounit: 2q2v.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO4 PIH 0.000295 0.5392 None
2 3ACC 5GP 0.03804 0.40234 None
3 1V0O INR 0.01813 0.40124 0.784314
4 2PT9 S4M 0.00009179 0.40599 1.24611
5 4GO7 THR 0.01447 0.40203 1.5
6 3GC0 AMP 0.01761 0.41205 1.56863
7 4BG1 IVL 0.002916 0.40246 1.96078
8 4BG1 OGA 0.002916 0.40246 1.96078
9 2ZYF AKG 0.008097 0.41694 2.35294
10 1G6O ADP 0.0007688 0.41666 2.35294
11 1TIW FAD 0.0008696 0.40026 2.7451
12 1TIW TFB 0.0008696 0.40026 2.7451
13 1L2T ATP 0.00004301 0.40672 2.97872
14 1KTC NGA 0.001557 0.45313 3.13725
15 2YVF FAD 0.0001043 0.44786 3.13725
16 2YVF NAD 0.000111 0.44786 3.13725
17 1A5Z OXM 0.04036 0.40966 3.13725
18 2C2A ADP 0.004875 0.40512 3.13725
19 1EXB NDP