Receptor
PDB id Resolution Class Description Source Keywords
1E3S 2 Å EC: 1.1.1.35 RAT BRAIN 3-HYDROXYACYL-COA DEHYDROGENASE BINARY COMPLEX WITH NADH RATTUS NORVEGICUS OXIDOREDUCTASE DEHYDROGENASE BETA-OXIDATION OF FATTY ACIDS STEROIDS AMYLOID BINDING
Ref.: RECOGNITION OF STRUCTURALLY DIVERSE SUBSTRATES BY TYPE II 3-HYDROXYACYL-COA DEHYDROGENASE (HADH II) AMYLOID-BETA BINDING ALCOHOL DEHYDROGENASE (ABAD) J.MOL.BIOL. V. 303 311 2000
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NAD A:301;
B:301;
C:301;
D:301;
Valid;
Valid;
Valid;
Valid;
none;
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
1E6W 1.7 Å EC: 1.1.1.35 RAT BRAIN 3-HYDROXYACYL-COA DEHYDROGENASE BINARY COMPLEX WIT ESTRADIOL RATTUS NORVEGICUS DEHYDROGENASE BETA-OXIDATION OF FATTY ACIDS STEROIDS AMYLBINDING
Ref.: RECOGNITION OF STRUCTURALLY DIVERSE SUBSTRATES BY T 3-HYDROXYACYL-COA DEHYDROGENASE (HADH II) AMYLOID-B BINDING ALCOHOL DEHYDROGENASE (ABAD) J.MOL.BIOL. V. 303 311 2000
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 6 families.
1 1E6W - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1E3S - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1E6W - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1E3S - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
3 1U7T Ki = 425 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
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 : 1E6W; 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: 1e6w.bio1) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1E6W; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 1e6w.bio1) has 29 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1E6W; Ligand: NAD; Similar sites found: 521
This union binding pocket(no: 3) in the query (biounit: 1e6w.bio1) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1LSS NAD 0.00004062 0.43694 None
2 1NYT NAP 0.00093 0.41015 1.15385
3 1C3V NDP 0.003704 0.4 1.22449
4 5IN4 6CK 0.000002327 0.60764 1.53846
5 5IN4 NAP 0.000002379 0.60764 1.53846
6 5IN4 GDP 0.000002785 0.60315 1.53846
7 1GV0 NAD 0.00003916 0.47305 1.53846
8 1GUZ NAD 0.00005747 0.46298 1.53846
9 4PLG NAI 0.0001942 0.45688 1.53846
10 4PLG OXM 0.02109 0.40358 1.53846
11 3LU1 NAD 0.0000000002144 0.67101 1.92308
12 9LDB NAD 0.00003888 0.47485 1.92308
13 9LDT NAD 0.00004065 0.47412 1.92308
14 1LTH NAD 0.00001657 0.46392 1.92308
15 2A92 NAI 0.0008753 0.42511 1.92308
16 5UAO FAD 0.001606 0.4224 1.92308
17 5T9F TYR 0.001789 0.41945 1.92308
18 3T31 FAD 0.006053 0.41309 1.92308
19 3T31 DCQ 0.006572 0.41309 1.92308
20 1X7D ORN 0.002737 0.41227 1.92308
21 5T9F NAP 0.002589 0.41208 1.92308
22 1X7D NAD 0.001398 0.4115 1.92308
23 4D3F NAP 0.0007706 0.40012 1.92308
24 5U8U FAD 0.0174 0.40009 1.92308
25 1RPN NDP 0.00000003723 0.59921 2.30769
26 3ABI NAD 0.00002659 0.47937 2.30769
27 4ZVV GN0 0.0001959 0.47746 2.30769
28 4ZVV NAD 0.0001959 0.47746 2.30769
29 3I6I NDP 0.0001078 0.46811 2.30769
30 3OA2 NAD 0.0003321 0.4345 2.30769
31 4DPL NAP 0.0009052 0.42172 2.30769
32 2NPX NAD 0.006369 0.41437 2.30769
33 1I8T FAD 0.002915 0.41338 2.30769
34 3L9W AMP 0.001694 0.41287 2.30769
35 2NPX FAD 0.002784 0.41199 2.30769
36 5J60 FAD 0.003385 0.41187 2.30769
37 3A06 FOM 0.002688 0.41144 2.30769
38 1Q0H NDP 0.005367 0.41043 2.30769
39 1PL6 572 0.002211 0.40981 2.30769
40 3A06 NDP 0.002578 0.40978 2.30769
41 1Q0H FOM 0.005322 0.40884 2.30769
42 1V59 FAD 0.006157 0.40631 2.30769
43 2Q7V FAD 0.005057 0.406 2.30769
44 1DXY NAD 0.001353 0.40492 2.30769
45 5EOW FAD 0.003531 0.40454 2.30769
46 1PL6 NAD 0.000502 0.40094 2.30769
47 2DC1 NAD 0.0005115 0.42471 2.54237
48 4GKV NAD 0.00008182 0.46722 2.67857
49 1UXG NAD 0.00004775 0.48187 2.69231
50 1O6Z NAD 0.00001918 0.46113 2.69231
51 1UWK NAD 0.0003706 0.45505 2.69231
52 1UWK URO 0.0003706 0.45505 2.69231
53 2CDU FAD 0.001027 0.42761 2.69231
54 1RYI FAD 0.001783 0.42386 2.69231
55 1X87 NAD 0.0003703 0.41435 2.69231
56 3GF4 FAD 0.006452 0.41195 2.69231
57 3GF4 UPG 0.007809 0.41071 2.69231
58 4MO2 FDA 0.003422 0.40851 2.69231
59 3H9E NAD 0.001199 0.40774 2.69231
60 3OND NAD 0.006941 0.40593 2.69231
61 3OND ADN 0.006941 0.40593 2.69231
62 4MO2 FAD 0.00435 0.40553 2.69231
63 1YQZ FAD 0.01143 0.40455 2.69231
64 2HK9 NAP 0.00174 0.40267 2.69231
65 5BUK FAD 0.007447 0.40212 2.69231
66 1UXG FUM 0.0259 0.40068 2.69231
67 1YJQ NAP 0.004285 0.40011 2.69231
68 5U5G NAP 0.002895 0.40007 2.69231
69 1OC2 TDX 0.0000002044 0.59688 3.07692
70 1OC2 NAD 0.0000002044 0.59688 3.07692
71 1E7S NAP 0.0000001682 0.56627 3.07692
72 3CMC NAD 0.002447 0.43644 3.07692
73 4J36 1HR 0.001595 0.4278 3.07692
74 4XB2 HSE 0.0007505 0.42764 3.07692
75 5UAV NDP 0.001032 0.42753 3.07692
76 5UAV TFB 0.001032 0.42753 3.07692
77 4XB2 NDP 0.0001878 0.42521 3.07692
78 4J36 FAD 0.001012 0.42405 3.07692
79 3NJ4 AFX 0.01478 0.42223 3.07692
80 3B1J NAD 0.001249 0.41646 3.07692
81 2BRY FAD 0.002421 0.40959 3.07692
82 4TXI FAD 0.002255 0.40948 3.07692
83 5G3U ITW 0.004902 0.40936 3.07692
84 3NJ4 NAD 0.0293 0.40884 3.07692
85 2WET FAD 0.005363 0.405 3.07692
86 5JCA FAD 0.006056 0.40387 3.07692
87 5JCA NDP 0.01303 0.4035 3.07692
88 1COY AND 0.01189 0.40248 3.07692
89 1COY FAD 0.006213 0.40248 3.07692
90 4IV9 FAD 0.006377 0.40106 3.07692
91 4N49 SAM 0.0006621 0.40094 3.07692
92 4YDD MGD 0.0208 0.40077 3.07692
93 4YDD MD1 0.0208 0.40077 3.07692
94 5G3U FDA 0.005884 0.4004 3.07692
95 2Q0L FAD 0.00711 0.40016 3.07692
96 1J5P NAD 0.0009971 0.4139 3.16206
97 1HDR NAD 0.00001607 0.51292 3.27869
98 4KP7 NAP 0.006068 0.40828 3.27869
99 4KP7 1UQ 0.006561 0.40341 3.27869
100 2R4J 13P 0.00415 0.41824 3.39321
101 2R4J FAD 0.00415 0.41824 3.39321
102 2CUL FAD 0.001145 0.42456 3.44828
103 5F5N NAD 0.000003032 0.50156 3.46021
104 4ZRN NAD 0.0000000006438 0.66282 3.46154
105 4ZRN UPG 0.000000004995 0.65412 3.46154
106 1RKX NAD 0.000000009434 0.61152 3.46154
107 3WMX NAD 0.00000001342 0.58694 3.46154
108 4Q9N NAI 0.00000006136 0.58077 3.46154
109 5JAQ NAI 0.00001492 0.50295 3.46154
110 5KKA 6V0 0.00002263 0.48541 3.46154
111 1I0Z NAI 0.00005961 0.46618 3.46154
112 4RPL 3UC 0.003438 0.4309 3.46154
113 4RPL FAD 0.003141 0.43056 3.46154
114 1HYH NAD 0.0007892 0.42541 3.46154
115 2F1K NAP 0.0005125 0.42057 3.46154
116 1D1T NAD 0.00118 0.42017 3.46154
117 2AQJ TRP 0.006793 0.41321 3.46154
118 2AQJ FAD 0.007063 0.41321 3.46154
119 2ZXI FAD 0.003417 0.40853 3.46154
120 3H8V ATP 0.0002484 0.40593 3.46154
121 4FWE FAD 0.006808 0.40277 3.46154
122 2GN4 UD1 0.00000001601 0.68181 3.84615
123 2GN4 NDP 0.00000001603 0.67945 3.84615
124 4OHU 2TK 0.00000001185 0.64749 3.84615
125 4OHU NAD 0.00000001185 0.64749 3.84615
126 4GLL NAD 0.000000003537 0.62997 3.84615
127 2YY7 NAD 0.000000004759 0.62275 3.84615
128 1V35 NAI 0.0000002979 0.57258 3.84615
129 2V6G NAP 0.0000008532 0.53756 3.84615
130 2GZ3 NAP 0.0002131 0.46772 3.84615
131 1RM0 NAI 0.0003205 0.45757 3.84615
132 1RM0 D6P 0.0004889 0.4532 3.84615
133 3GGO NAI 0.0004493 0.44744 3.84615
134 3GGO ENO 0.0004493 0.44744 3.84615
135 1MV8 NAD 0.0002892 0.43 3.84615
136 1MUU NAD 0.0003516 0.42368 3.84615
137 1J0X NAD 0.002155 0.42262 3.84615
138 1DSS NAD 0.0005221 0.41885 3.84615
139 2G5C NAD 0.001189 0.41727 3.84615
140 1E1M NAP 0.004606 0.41718 3.84615
141 1E1M FAD 0.004606 0.41718 3.84615
142 3AYI HCI 0.005191 0.41506 3.84615
143 3AYI FAD 0.004967 0.41506 3.84615
144 2ZJ1 ARJ 0.004931 0.41439 3.84615
145 2ZJ1 NAD 0.004975 0.41424 3.84615
146 4R5M 4NO 0.001728 0.41254 3.84615
147 3NYC FAD 0.005728 0.41175 3.84615
148 3NYC IAR 0.005728 0.41175 3.84615
149 4R5M NAP 0.001384 0.4112 3.84615
150 2PT9 2MH 0.002435 0.41073 3.84615
151 3QJ4 FAD 0.004126 0.40642 3.84615
152 2I7C AAT 0.003129 0.40533 3.84615
153 1GAD NAD 0.001647 0.40403 3.84615
154 5KMS NAD 0.007247 0.41205 3.95062
155 4D42 NAP 0.00000002727 0.62589 4.23077
156 4D42 W0I 0.00000002727 0.62589 4.23077
157 2PD4 DCN 0.00000004408 0.59446 4.23077
158 2PD4 NAD 0.00000005365 0.59117 4.23077
159 5MSO NAP 0.00000002662 0.57606 4.23077
160 1EZ4 NAD 0.00003329 0.46268 4.23077
161 5MDH NAD 0.00005411 0.45926 4.23077
162 1LDM NAD 0.0001143 0.45554 4.23077
163 4MDH NAD 0.00009985 0.44986 4.23077
164 3O9Z NAD 0.0005096 0.44953 4.23077
165 1T26 NAI 0.0004533 0.44839 4.23077
166 3O9Z AKG 0.0009234 0.43823 4.23077
167 1VKO NAD 0.0003981 0.43811 4.23077
168 3WGT FAD 0.002174 0.42621 4.23077
169 3V1Y NAD 0.0003872 0.4254 4.23077
170 3CGB FAD 0.001278 0.42512 4.23077
171 3WGT QSC 0.002584 0.42407 4.23077
172 5JWC FAD 0.001301 0.42241 4.23077
173 3ZNN 4WL 0.004075 0.42163 4.23077
174 3ZNN FAD 0.004075 0.42163 4.23077
175 2IXB A2G 0.002204 0.41704 4.23077
176 2IXB NAD 0.001699 0.41282 4.23077
177 5BVA FAD 0.004315 0.41157 4.23077
178 3TWO NDP 0.002853 0.40928 4.23077
179 1YKJ PHB 0.01119 0.40689 4.23077
180 1YKJ FAD 0.01119 0.40689 4.23077
181 4HSU FAD 0.005831 0.40636 4.23077
182 4GUT FAD 0.006751 0.40557 4.23077
183 4EIP K2C 0.007885 0.40286 4.23077
184 4EIP FAD 0.007885 0.40286 4.23077
185 4GUS FAD 0.007394 0.40225 4.23077
186 2NAD NAD 0.004853 0.40039 4.23077
187 2Q46 NAP 0.0000002002 0.55482 4.34783
188 1VL0 NAI 0.000000001473 0.613 4.61538
189 3RFV NAI 0.00000002316 0.58411 4.61538
190 2C29 NAP 0.0000002765 0.5769 4.61538
191 2PZM NAD 0.000000712 0.56062 4.61538
192 2PZM UDP 0.000000712 0.56062 4.61538
193 2C29 DQH 0.0000008353 0.55787 4.61538
194 3RFV 15L 0.000001144 0.51726 4.61538
195 2HJR APR 0.000009227 0.4673 4.61538
196 1SOW NAD 0.0001278 0.45686 4.61538
197 1A5Z NAD 0.00009429 0.42657 4.61538
198 1H2B NAJ 0.000883 0.42631 4.61538
199 2I3G NAP 0.0008976 0.4233 4.61538
200 2JHF NAD 0.01747 0.4231 4.61538
201 1NVM NAD 0.001778 0.41207 4.61538
202 5EZ7 FAD 0.005247 0.40338 4.61538
203 2VYN NAD 0.0024 0.40293 4.61538
204 5TTJ FAD 0.005823 0.40161 4.61538
205 1ZK7 FAD 0.006736 0.40474 4.92505
206 1N7G NDP 0.0000003178 0.60188 5
207 1N7G GDR 0.0000003814 0.58579 5
208 2Q1W NAD 0.0000000908 0.57644 5
209 4OOE NDP 0.001296 0.4532 5
210 4OOE FOM 0.001296 0.4532 5
211 4RSL FAD 0.0002522 0.45118 5
212 2PV7 NAD 0.0005337 0.42436 5
213 2JL1 NAP 0.000176 0.4243 5
214 3ICR FAD 0.00284 0.41165 5
215 3ICT FAD 0.003039 0.41051 5
216 5MZI FYK 0.008943 0.40964 5
217 5MZI FAD 0.008614 0.40964 5
218 1HYE NAP 0.0005278 0.40953 5
219 3ICS FAD 0.003448 0.40946 5
220 1GR0 NAD 0.003261 0.40586 5
221 4D04 NAP 0.01278 0.40449 5
222 4D04 FAD 0.01278 0.40449 5
223 3CTY FAD 0.006944 0.40334 5
224 1KEW TYD 0.00000008611 0.60572 5.38462
225 1KEW NAD 0.0000002345 0.58946 5.38462
226 2Q1S NAI 0.0000004457 0.56868 5.38462
227 1D7O NAD 0.0000006995 0.55167 5.38462
228 5L4L NAP 0.000002143 0.49976 5.38462
229 5L4L 7OX 0.00004124 0.48298 5.38462
230 2QRK AMP 0.001547 0.42303 5.38462
231 3JV7 NAD 0.0009109 0.42162 5.38462
232 1E5Q NDP 0.0008187 0.42068 5.38462
233 1D7O TCL 0.03247 0.42057 5.38462
234 1D4D FAD 0.004536 0.40979 5.38462
235 1DLJ UGA 0.00706 0.40727 5.38462
236 1GTE FAD 0.01117 0.40563 5.38462
237 1DLJ NAI 0.007776 0.40557 5.38462
238 3HDY FAD 0.01232 0.40451 5.38462
239 3E1T FAD 0.006869 0.40262 5.38462
240 3HDY FDA 0.01443 0.40165 5.38462
241 3HDY GDU 0.01494 0.40165 5.38462
242 4M73 SAH 0.005218 0.40029 5.38462
243 1XHC FAD 0.003899 0.40519 5.72207
244 5CAE COA 0.0009261 0.40296 5.7508
245 3OIG NAD 0.00000004446 0.57409 5.76923
246 2CVQ NDP 0.0002817 0.43737 5.76923
247 2B4R NAD 0.0004947 0.43308 5.76923
248 4MIG G3F 0.003086 0.42097 5.76923
249 3L4S 3PG 0.001409 0.41856 5.76923
250 3L4S NAD 0.001301 0.41856 5.76923
251 1B8U OAA 0.001716 0.41399 5.76923
252 4MOP 2H5 0.005328 0.41382 5.76923
253 2VVM FAD 0.003175 0.41297 5.76923
254 3B1F NAD 0.0003795 0.41246 5.76923
255 4G74 UQ5 0.005193 0.411 5.76923
256 1B8U NAD 0.000247 0.41098 5.76923
257 1REO FAD 0.003431 0.41061 5.76923
258 4G74 FAD 0.002855 0.41043 5.76923
259 2B4R AES 0.00197 0.40901 5.76923
260 2VVL FAD 0.00435 0.40859 5.76923
261 4AP3 FAD 0.01048 0.40678 5.76923
262 4AP3 NAP 0.01048 0.40678 5.76923
263 2IID PHE 0.008685 0.40667 5.76923
264 2IID FAD 0.008685 0.40667 5.76923
265 3UOY FAD 0.01309 0.40649 5.76923
266 3UOY NAP 0.01309 0.40649 5.76923
267 3NT6 FAD 0.004668 0.40433 5.76923
268 5TS5 FAD 0.005732 0.40386 5.76923
269 3KB6 NAD 0.002163 0.40132 5.76923
270 1WP4 NDP 0.002302 0.40019 5.76923
271 3KO8 NAD 0.0000000005576 0.66045 6.15385
272 4R1S NAP 0.000000007526 0.59448 6.15385
273 1WVG APR 0.000000299 0.53227 6.15385
274 2V6O FAD 0.005576 0.4251 6.15385
275 2VHW NAI 0.001271 0.42403 6.15385
276 5HSA FAS 0.002681 0.41687 6.15385
277 1H82 GZZ 0.006704 0.41551 6.15385
278 1H82 FAD 0.005652 0.41505 6.15385
279 1QO8 FAD 0.005457 0.40566 6.15385
280 4YRY NAD 0.009305 0.4047 6.15385
281 4YRY FAD 0.006769 0.40195 6.15385
282 1HDO NAP 0.0000008982 0.54231 6.31068
283 3WLE NAD 0.002484 0.41277 6.45161
284 1XSE NDP 0.000000000109 0.70584 6.53846
285 1UDB NAD 0.00000001934 0.63334 6.53846
286 2X6T NAP 0.0000004547 0.54585 6.53846
287 1EQ2 NAP 0.000001177 0.53032 6.53846
288 2PK3 A2R 0.00000006052 0.52505 6.53846
289 4X9M FAD 0.002231 0.41899 6.53846
290 1SAY PYR 0.001622 0.4175 6.53846
291 3QV1 NAD 0.0005648 0.41567 6.53846
292 5FJN BE2 0.004881 0.41034 6.53846
293 5FJN FAD 0.004156 0.41034 6.53846
294 1Y8Q ATP 0.0007391 0.40656 6.53846
295 2C5A NAD 0.000000008495 0.65066 6.92308
296 2C5A GDC 0.000000008495 0.65066 6.92308
297 1I2B NAD 0.0000001071 0.60711 6.92308
298 1I2B UPG 0.0006393 0.48493 6.92308
299 1I2B USQ 0.0006393 0.48493 6.92308
300 5JY6 NAD 0.003445 0.41988 6.92308
301 3AXB PRO 0.002544 0.41878 6.92308
302 3AXB FAD 0.002061 0.41706 6.92308
303 2QZZ NAP 0.00228 0.41536 6.92308
304 2QZZ EMF 0.002435 0.41536 6.92308
305 5JE8 NAD 0.001027 0.4065 6.92308
306 5M67 ADE 0.007172 0.40618 6.92308
307 5M67 NAD 0.007201 0.40611 6.92308
308 5M67 3D1 0.007264 0.40596 6.92308
309 1YY5 FAD 0.006693 0.40397 6.92308
310 1RSG FAD 0.006218 0.40341 6.92308
311 3AD8 PYC 0.005876 0.42051 7.07071
312 3AD8 FAD 0.005876 0.42051 7.07071
313 1SB8 UD2 0.000000001428 0.68069 7.30769
314 1SB8 NAD 0.000000001926 0.66917 7.30769
315 4PIV NDP 0.00000006147 0.58075 7.30769
316 4K28 NAD 0.0006374 0.4126 7.30769
317 1V8B NAD 0.003404 0.40747 7.30769
318 5DN9 NAD 0.002872 0.40675 7.30769
319 2IVD FAD 0.00503 0.40307 7.30769
320 2DT5 NAD 0.000694 0.42256 7.58294
321 1R6D NAD 0.00000004781 0.62011 7.69231
322 1R6D DAU 0.0000001182 0.60281 7.69231
323 3G5S FAD 0.001446 0.42304 7.69231
324 4OPC FDA 0.01259 0.41935 7.69231
325 4OPC PGT 0.01465 0.41935 7.69231
326 3QVP FAD 0.007248 0.40169 7.69231
327 3AB1 FAD 0.00617 0.40162 7.69231
328 1PS9 FAD 0.006547 0.40158 7.69231
329 5J7X FAD 0.005759 0.40077 7.69231
330 4B7X NAP 0.004567 0.40025 7.69231
331 4J4H NAI 0.004991 0.41084 7.72201
332 4J4H 1J1 0.004991 0.41084 7.72201
333 4JK3 NAD 0.001791 0.40123 7.72201
334 4HXY NDP 0.00000000001774 0.71456 8.07692
335 3VPH NAD 0.000164 0.45422 8.07692
336 3VPH OXM 0.000316 0.44608 8.07692
337 3CIF NAD 0.0002983 0.43663 8.07692
338 3CIF G3H 0.002592 0.41089 8.07692
339 1BZL FAD 0.02312 0.40729 8.07692
340 1HDG NAD 0.001032 0.40712 8.07692
341 5LD5 NAD 0.0006519 0.40709 8.07692
342 3GD4 NAD 0.01799 0.404 8.07692
343 3NTA FAD 0.004761 0.40399 8.07692
344 3GD4 FAD 0.01168 0.40348 8.07692
345 4E5N NAD 0.003619 0.40167 8.07692
346 3NTD FAD 0.005854 0.40049 8.07692
347 1R37 NAD 0.001408 0.41986 8.35735
348 2DKH FAD 0.001611 0.41634 8.46154
349 2Y6Q FAD 0.001943 0.41194 8.46154
350 2DKH 3HB 0.003178 0.41191 8.46154
351 2Y6Q I7T 0.004953 0.41097 8.46154
352 4L8V NAP 0.002345 0.40616 8.46154
353 2WPF FAD 0.03134 0.40103 8.46154
354 4YSX FAD 0.002937 0.4143 8.51064
355 3MJE NDP 0.0000000000365 0.69993 8.66935
356 2BKA NDP 0.0000006819 0.5344 8.67769
357 1LDN NAD 0.0001558 0.45205 8.84615
358 4TQG NDP 0.000000004017 0.61693 9.23077
359 2EXX NAP 0.00007239 0.46926 9.23077
360 4PLT NAI 0.0002694 0.4692 9.23077
361 4PLT OXM 0.0004006 0.46039 9.23077
362 1Y1P NMN AMP PO4 0.000002407 0.49228 9.61539
363 4DSG UDP 0.006227 0.41616 9.61539
364 4DSG FAD 0.006227 0.41616 9.61539
365 2RAB NAD 0.01598 0.40225 9.61539
366 1U1I NAD 0.0002753 0.44703 10
367 2DFV NAD 0.0008025 0.41717 10
368 2HMT NAI 0.00003989 0.44207 10.4167
369 4U7W NDP 0.00000006875 0.56638 10.7692
370 1LLU NAD 0.0005401 0.43581 10.7692
371 5BR7 FLC 0.00353 0.42708 10.7692
372 5BR7 FAD 0.00353 0.42708 10.7692
373 2E5V FAD 0.004809 0.40878 10.7692
374 1GY8 NAD 0.00000001111 0.60883 11.1538
375 4ZGS NAD 0.0004303 0.4146 11.1538
376 3GFB NAD 0.001321 0.40931 11.1538
377 5L95 AMP 0.0001934 0.41213 11.25
378 4PVD NDP 0.0000003294 0.53581 11.5385
379 1PZG A3D 0.0002632 0.45175 11.5385
380 1KOL NAD 0.00241 0.41328 11.5385
381 2XVE FAD 0.01278 0.4032 11.5385
382 1E6E FAD 0.001795 0.41823 11.7188
383 1ORR NAD 0.000000001045 0.65246 11.9231
384 1U3U NAD 0.003266 0.41449 11.9231
385 1U3U BNF 0.003266 0.41449 11.9231
386 2QA1 FAD 0.00298 0.40855 11.9231
387 1H9A NAP 0.002492 0.41034 12.3077
388 3A4V NAD 0.000000001807 0.64998 12.6923
389 3A4V PYR 0.000000001807 0.64998 12.6923
390 2Z3Y F2N 0.004153 0.41131 12.6923
391 5CG1 NAD BBN 0.0000004003 0.59054 13.0769
392 1CER NAD 0.0002644 0.45183 13.0769
393 2FZW NAD 0.002561 0.41964 13.0769
394 2JB2 FAD 0.005782 0.40173 13.0769
395 2JB2 PHE 0.006615 0.40043 13.0769
396 1NNU NAD 0.0000005396 0.5994 13.3333
397 1NNU TCT 0.007599 0.45033 13.3333
398 1HKU NAD 0.00205 0.40973 13.4615
399 1QG6 TCL 0.00000003478 0.61259 13.8462
400 1QG6 NAD 0.00000003478 0.61259 13.8462
401 4O1M NAD 0.00000007351 0.57562 14.6154
402 3CGD FAD 0.007447 0.42199 14.6154
403 3CGD COA 0.007447 0.42199 14.6154
404 3CGD NAD 0.007447 0.42199 14.6154
405 4E13 NAD 0.0002191 0.41503 14.6154
406 4JDR FAD 0.00506 0.406 15
407 5L4S 6KX 0.00000000007913 0.70477 15.3846
408 5L4S NAP 0.00000000007913 0.70477 15.3846
409 1E3I CXF 0.0008687 0.43042 15.3846
410 4RQU NAD 0.001129 0.41475 15.3846
411 5GT9 NAP 0.0000000001874 0.67586 15.7692
412 1JNR FAD 0.01027 0.41439 15.7692
413 3WQQ IB3 0.003471 0.41246 15.7692
414 3WQQ NDP 0.003471 0.41246 15.7692
415 4EUE NAI 0.0000005105 0.54796 16.1538
416 3O26 NDP 0.000000000003228 0.73956 16.9231
417 4W6Z 8ID 0.0008938 0.42994 17.3077
418 1Z45 NAD 0.000000004819 0.62015 17.6923
419 2FR1 NDP 0.0000000004847 0.66276 18.0769
420 1WMA AB3 0.0000000004464 0.68757 18.4615
421 1WMA NDP 0.0000000004464 0.68757 18.4615
422 3OJF IMJ 0.00000001758 0.62097 19.0661
423 3OJF NDP 0.0000000164 0.61098 19.0661
424 4XQC 13D 0.0001726 0.4672 19.2308
425 4XQC NAD 0.0002141 0.46239 19.2308
426 1BXK NAD 0.000000006935 0.6083 19.6154
427 1FK8 NAD 0.000000000003766 0.70259 19.8444
428 1EK6 NAI 0.00000000834 0.65098 21.1538
429 1EK6 UPG 0.00000008665 0.61213 21.1538
430 1N5D NDP 0.0000000001364 0.68108 21.5385
431 2GAG FAD 0.00323 0.41751 22.2222
432 2GAG FOA 0.006298 0.40591 22.2222
433 3TN7 NJP 0.000000000003371 0.74183 22.5681
434 5L53 NAP 0.000000001381 0.58949 24.6154
435 3LZW NAP 0.005904 0.41572 26.9231
436 3LZW FAD 0.002383 0.41572 26.9231
437 3ORF NAD 0.0000001056 0.56476 29.8805
438 1SNY NAP 0.000000003718 0.60669 30
439 1Z6Z NAP 0.000000002208 0.6329 30.1418
440 2BD0 NAP 0.00000000000009237 0.80406 30.3279
441 4J1Q NDP 0.0000000006051 0.6411 30.3846
442 4K26 NDP 0.0000000006101 0.65648 31.5385
443 4K26 SFF 0.000000001827 0.65588 31.5385
444 4J7U YTZ 0.000000002836 0.65398 31.5972
445 4J7U NAP 0.000000002836 0.65398 31.5972
446 1OAA OAA 0.000000000357 0.69142 32.4324
447 3CH6 NAP 0.000000002141 0.68465 33.4615
448 3CH6 311 0.000000002141 0.68465 33.4615
449 1BDB NAD 0.00000000001607 0.72164 33.8462
450 3RKR NAP 0.000004804 0.4244 34.3511
451 4YAG NAI 0.000000000002592 0.77403 34.6154
452 3RJ5 NAD 0.00000000002538 0.72623 34.6457
453 3HB5 NAP 0.0000000001235 0.71882 35
454 1XG5 NAP 0.00000000002046 0.71222 35
455 1A27 NAP 0.0000000001136 0.68138 35
456 3ZV6 4HB 0.000000000002095 0.77769 35.3846
457 3ZV6 NAD 0.000000000001839 0.77769 35.3846
458 3WXB NDP 0.00000000001974 0.71281 36.1538
459 2WYV NAD 0.000001423 0.52721 36.1538
460 3U4C NDP 0.0000000007352 0.6436 36.9231
461 2JAH NDP 0.0000000000002709 0.78323 37.247
462 1W8D NAP 0.00000000001976 0.66737 37.3077
463 1W73 NAP 0.00000000003259 0.66053 37.3077
464 2JAP NDP 0.0000000000002239 0.78635 38.0567
465 1GZ6 NAI 0.00000000005246 0.69676 38.0769
466 1W6U NAP 0.00000000001494 0.67189 38.8462
467 1MXH DHF 0.00000002829 0.60756 40.3846
468 1MXH NAP 0.00000004355 0.60026 40.3846
469 4O0L NDP 0.0000000000004928 0.7734 41.0909
470 3AFN NAP 0.000000000002792 0.75064 41.4729
471 3V1U NAD 0.0000000000002613 0.74176 41.9231
472 1X1T NAD 0.0000000000129 0.72528 41.9231
473 2DKN NAI 0.000000000000007661 0.82798 41.9608
474 3OID NDP 0.000000000003939 0.74494 42.2481
475 3H4V DVP 0.000000005003 0.64423 42.3077
476 2VZ0 D64 0.00000005527 0.63979 42.3077
477 2VZ0 NAP 0.00000005527 0.63979 42.3077
478 3H4V NAP 0.00000002073 0.61815 42.3077
479 2WD7 NAP 0.000000004918 0.61404 42.3077
480 3D3W NAP 0.00000000000895 0.73134 42.623
481 3SJU NDP 0.00000000000006883 0.80572 42.6923
482 5K6A NAP 0.000000001181 0.64312 42.6923
483 4CM9 NAP 0.000000001235 0.64239 42.6923
484 3BMQ NAP 0.000000001593 0.63823 42.6923
485 3JQF NAP 0.000000001602 0.63815 42.6923
486 3BMN NAP 0.000000001872 0.6356 42.6923
487 3JQ8 NAP 0.000000002131 0.63348 42.6923
488 4CME NAP 0.000000001718 0.63087 42.6923
489 3JQ9 NAP 0.000000004418 0.62157 42.6923
490 4CM8 NAP 0.00000000351 0.61932 42.6923
491 5JCJ NAP 0.000000003719 0.61842 42.6923
492 4CM4 NAP 0.000000003726 0.61834 42.6923
493 3BMO NAP 0.000000003882 0.61777 42.6923
494 5JDC NAP 0.000000003938 0.61751 42.6923
495 4CLR NAP 0.000000004367 0.61594 42.6923
496 5JDI NAP 0.000000004673 0.61478 42.6923
497 4CLO NAP 0.000000003969 0.61131 42.6923
498 4CMI NAP 0.000000006564 0.60939 42.6923
499 3JQA NAP 0.000000007813 0.60072 42.6923
500 3JQG NAP 0.000000009762 0.59696 42.6923
501 3JQB NAP 0.00000001097 0.5953 42.6923
502 3JQ7 NAP 0.00000001173 0.59405 42.6923
503 4OSP NAP 0.000000000005845 0.72137 43.4615
504 2WSB NAD 0.000000000000008216 0.86766 43.7008
505 2Q2V NAD 0.000000000001034 0.7671 44.3137
506 5THQ NDP 0.00000000001781 0.71166 44.4853
507 3GEG NAD 0.00000000001634 0.69731 44.5344
508 4ITU 1HS 0.0000000000003678 0.80754 44.9814
509 4ITU NAI 0.00000000000009004 0.80754 44.9814
510 4FC7 NAP 0.00000000004253 0.72604 45
511 4FC7 COA 0.00000000004253 0.72604 45
512 1G0N PHH 0.0000000000002247 0.81363 45.3846
513 1G0N NDP 0.0000000000002013 0.80804 45.3846
514 1ZEM NAD 0.000000000003944 0.70984 45.7692
515 2EWM NAD 0.0000000000003342 0.77978 46.5863
516 3NUG NAD 0.00000000000004186 0.81388 48.1781
517 2AE2 PTO 0.000000000001514 0.7787 48.8462
518 2AE2 NAP 0.000000000001514 0.7787 48.8462
519 4ZA2 NAD 0.000000000002366 0.73738 49.0119
520 5T2U NAP 0.0000000000008381 0.77058 49.5968
521 1NFQ NAI 0.000000000000003331 0.85877 49.6154
Pocket No.: 4; Query (leader) PDB : 1E6W; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1e6w.bio1) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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