Receptor
PDB id Resolution Class Description Source Keywords
2O4C 2.3 Å EC: 1.1.1.290 CRYSTAL STRUCTURE OF D-ERYTHRONATE-4-PHOSPHATE DEHYDROGENASE WITH NAD PSEUDOMONAS AERUGINOSA ERYTHRONATE-4-PHSPHATE DEHYDROGENASE NAD TARTRATE PHOSPHOXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF D-ERYTHRONATE-4-PHOSPHATE DEHY COMPLEXED WITH NAD J.MOL.BIOL. V. 366 1294 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GOL B:2647;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
NAD A:1002;
B:1001;
Valid;
Valid;
none;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
PO4 A:900;
Invalid;
none;
submit data
94.971 O4 P [O-]P...
TLA B:500;
Valid;
none;
submit data
150.087 C4 H6 O6 [C@@H...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2O4C 2.3 Å EC: 1.1.1.290 CRYSTAL STRUCTURE OF D-ERYTHRONATE-4-PHOSPHATE DEHYDROGENASE WITH NAD PSEUDOMONAS AERUGINOSA ERYTHRONATE-4-PHSPHATE DEHYDROGENASE NAD TARTRATE PHOSPHOXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF D-ERYTHRONATE-4-PHOSPHATE DEHY COMPLEXED WITH NAD J.MOL.BIOL. V. 366 1294 2007
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2O4C - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2O4C - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2O4C - NAD C21 H27 N7 O14 P2 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
Ligand no: 2; Ligand: TLA; Similar ligands found: 13
No: Ligand ECFP6 Tc MDL keys Tc
1 SRT 1 1
2 TLA 1 1
3 TAR 1 1
4 RAT 0.588235 1
5 GAE 0.588235 1
6 LGT 0.588235 1
7 LAC 0.5 0.611111
8 2OP 0.5 0.611111
9 IPM 0.47619 0.8
10 LFC 0.434783 0.777778
11 ICT 0.416667 0.727273
12 DXX 0.411765 0.777778
13 MAK 0.4 0.941176
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2O4C; Ligand: NAD; Similar sites found: 515
This union binding pocket(no: 1) in the query (biounit: 2o4c.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1P31 EPU 0.01136 0.40747 1.05263
2 1SAY PYR 0.00001463 0.47033 1.10803
3 2V77 PAY 0.02393 0.40196 1.2945
4 2GV8 NDP 0.002193 0.42277 1.31579
5 2GVC FAD 0.0005154 0.41967 1.31579
6 1VQW FAD 0.0005247 0.41942 1.31579
7 2GV8 FAD 0.0006738 0.41109 1.31579
8 2GZ3 NAP 0.0001548 0.4342 1.36612
9 3H9E NAD 0.000004252 0.52471 1.44509
10 5AHO TLA 0.02375 0.40846 1.4881
11 2BH9 NAP 0.000254 0.49227 1.57895
12 1LVL NAD 0.0001186 0.48786 1.57895
13 2D2I NAP 0.00006171 0.48669 1.57895
14 5TUK FAD 0.002393 0.4125 1.57895
15 5E9W SAH 0.02651 0.40317 1.60256
16 1U3U BNF 0.0000139 0.43488 1.60428
17 1U3U NAD 0.0000139 0.43488 1.60428
18 3WCZ CIT 0.01589 0.4086 1.62338
19 1X7D NAD 0.000007076 0.50704 1.71429
20 1X7D ORN 0.000009308 0.46202 1.71429
21 3TWO NDP 0.00001175 0.46845 1.72414
22 1R37 NAD 0.00002779 0.46081 1.72911
23 4RDH AMP 0.00001786 0.54677 1.73611
24 4RDI ATP 0.00004096 0.51834 1.73611
25 1NVT NAP 0.0001746 0.46808 1.74216
26 3B20 NAD 0.00004212 0.49352 1.76991
27 3B1J NAD 0.00008768 0.4615 1.76991
28 5DOZ NDP 0.0008194 0.41379 1.77515
29 3V1Y NAD 0.0000005405 0.56034 1.78042
30 1R6D NAD 0.001419 0.43535 1.78042
31 1R6D DAU 0.00187 0.42972 1.78042
32 1HDG NAD 0.00004209 0.48925 1.80723
33 1V6A TRE 0.001443 0.48307 1.80723
34 1J0X NAD 0.00001657 0.42601 1.80723
35 4D79 ATP 0.000008603 0.54907 1.81159
36 1LDM NAD 0.000001117 0.53313 1.82371
37 2YVF NAD 0.0003192 0.46727 1.84211
38 2YVF FAD 0.0003051 0.46727 1.84211
39 2Y6Q FAD 0.000268 0.43501 1.84211
40 5KVS NAP 0.001275 0.43247 1.84211
41 3KLJ FAD 0.0003026 0.42811 1.84211
42 5JWC FAD 0.0002715 0.42103 1.84211
43 4R5M NAP 0.001206 0.42125 1.8617
44 4R5M 4NO 0.00153 0.41189 1.8617
45 3KIF GDL 0.03393 0.40891 1.88679
46 4UP3 NDP 0.001263 0.43946 1.91083
47 4YCA NDP 0.00003515 0.48823 2.04082
48 3L4S NAD 0.0001061 0.44951 2.08333
49 3L4S 3PG 0.0001164 0.44284 2.08333
50 3JQA NAP 0.0007142 0.43305 2.08333
51 4CLO NAP 0.0007709 0.43175 2.08333
52 3JQB NAP 0.0008231 0.43063 2.08333
53 3JQG NAP 0.0008351 0.43039 2.08333
54 4CMI NAP 0.0007028 0.43027 2.08333
55 4CLR NAP 0.0007683 0.42878 2.08333
56 4CME NAP 0.0007765 0.4286 2.08333
57 3BMO NAP 0.000825 0.42759 2.08333
58 4CM8 NAP 0.0008597 0.4269 2.08333
59 5JCJ NAP 0.0009042 0.42606 2.08333
60 5JDC NAP 0.0009143 0.42587 2.08333
61 4CM4 NAP 0.0009164 0.42584 2.08333
62 5JDI NAP 0.0009437 0.42535 2.08333
63 3JQF NAP 0.0007962 0.42527 2.08333
64 3BMQ NAP 0.0009503 0.42236 2.08333
65 4CM9 NAP 0.0009999 0.42153 2.08333
66 3JQ8 NAP 0.0009998 0.42153 2.08333
67 3BMN NAP 0.001099 0.41998 2.08333
68 5K6A NAP 0.000816 0.41904 2.08333
69 3JQ9 NAP 0.001361 0.41646 2.08333
70 3JQ7 NAP 0.003311 0.40698 2.08333
71 4XB2 HSE 0.00001711 0.48618 2.08955
72 4XB2 NDP 0.000001805 0.48502 2.08955
73 4BVA NDP 0.00002135 0.4809 2.08955
74 4BVA T3 0.000105 0.42383 2.08955
75 1O0S NAI 0.00002664 0.50633 2.10526
76 5HV7 RBL 0.004131 0.45281 2.10526
77 5FJJ MAN 0.009522 0.42701 2.10526
78 3IHG FAD 0.001853 0.41408 2.10526
79 2GLX NDP 0.0004812 0.44993 2.10843
80 2I7C AAT 0.001063 0.4057 2.12014
81 3F8D FAD 0.01349 0.40561 2.16718
82 1GR0 NAD 0.000001967 0.50044 2.17984
83 1F06 2NP 0.0001543 0.43517 2.1875
84 1F06 NDP 0.0001543 0.43517 2.1875
85 1LDN NAD 0.0000003923 0.54546 2.21519
86 4DPL NAP 0.00002864 0.47987 2.22841
87 5LD5 NAD 0.00001923 0.51227 2.23464
88 2X6T NAP 0.001254 0.41781 2.2409
89 2DFV NAD 0.000002671 0.52794 2.30548
90 2AF6 BRU 0.04883 0.40132 2.32558
91 1LLU NAD 0.000001633 0.50243 2.33918
92 3FGZ BEF 0.01794 0.40475 2.34375
93 1ZMD NAI 0.00006422 0.48182 2.36842
94 1U1I NAD 0.00004255 0.45498 2.36842
95 2IVD FAD 0.0002025 0.42104 2.36842
96 4TQG NDP 0.001319 0.41975 2.36842
97 1N1G BCP 0.0003224 0.41905 2.36842
98 1N9G NAP 0.00244 0.41786 2.36842
99 4PIV NDP 0.002379 0.4126 2.36842
100 5K8P 6R8 0.02794 0.40941 2.36842
101 2ZWS PLM 0.0351 0.40371 2.36842
102 3SJ7 NDP 0.0009607 0.42505 2.38095
103 1RPN NDP 0.002375 0.40066 2.38806
104 3ABI NAD 0.000002205 0.52196 2.46575
105 1EBF NAD 0.000004257 0.53454 2.51397
106 5KVA SAM 0.006055 0.41031 2.51799
107 4O0L NDP 0.002227 0.40582 2.54545
108 2ZB3 NDP 0.00301 0.40596 2.54958
109 5CAE COA 0.000003817 0.53649 2.55591
110 1HYE NAP 0.0000393 0.49924 2.55591
111 5CAE SIN 0.00001873 0.47122 2.55591
112 1GV0 NAD 0.000001312 0.53049 2.58065
113 1GUZ NAD 0.000001014 0.52114 2.58065
114 1EQ2 NAP 0.001159 0.4191 2.58065
115 1UXG NAD 0.000001325 0.48451 2.589
116 3QWI NAP 0.001273 0.4108 2.59259
117 2WD7 NAP 0.0008079 0.42794 2.61194
118 1PS9 NAP 0.0001252 0.46628 2.63158
119 1PZG A3D 0.00001091 0.46005 2.63158
120 5E4R NAP 0.0005636 0.43395 2.63158
121 2RGJ FAD 0.000398 0.42372 2.63158
122 5TS5 FAD 0.0002106 0.40095 2.63158
123 1DSS NAD 0.0000007882 0.55917 2.7027
124 5U5G NAP 0.00004696 0.47544 2.71186
125 1B8U NAD 0.00001742 0.52416 2.73556
126 1B8U OAA 0.0001631 0.44306 2.73556
127 1O8B ABF 0.03749 0.40267 2.73973
128 2CVQ NDP 0.000008339 0.5043 2.75229
129 1ZBQ NAD 0.002405 0.40073 2.75229
130 3CIF NAD 0.0000009501 0.54056 2.78552
131 3CIF G3H 0.00001529 0.46254 2.78552
132 3WMX NAD 0.0002835 0.45216 2.7933
133 4NBU NAI 0.00291 0.40149 2.8
134 2B5W NAP 0.0001108 0.43568 2.80112
135 2DT5 NAD 0.0000006664 0.54648 2.8436
136 1EDO NAP 0.001263 0.41091 2.86885
137 3O9Z NAD 0.00005226 0.40572 2.88462
138 1UAY ADN 0.02125 0.40448 2.89256
139 2IZ1 ATR 0.0002632 0.52739 2.89474
140 3JV7 NAD 0.000008818 0.49921 2.89474
141 1MO9 FAD 0.001298 0.4523 2.89474
142 1MO9 KPC 0.001371 0.45187 2.89474
143 2OOR NAD 0.0009868 0.44404 2.89474
144 1F8G NAD 0.001052 0.44285 2.89474
145 2QRK AMP 0.00003127 0.44017 2.89474
146 1L7E NAI 0.001617 0.42822 2.89474
147 3OBT SLB 0.03512 0.41258 2.89474
148 3CGB FAD 0.0004191 0.40548 2.89474
149 3C7A NAD 0.02995 0.40052 2.89474
150 2B4R NAD 0.000003789 0.50883 2.89855
151 2B4R AES 0.000006858 0.50334 2.89855
152 4D3F NAP 0.00001595 0.52065 2.90323
153 4XDZ NDP 0.0006419 0.44134 2.91545
154 4PLG NAI 0.000001534 0.48724 2.99401
155 1P1C SAH 0.0001748 0.47204 3.01508
156 5KQA GSH 0.03422 0.40727 3.0303
157 2EV9 NAP 0.0001562 0.44372 3.04183
158 2EV9 SKM 0.0001562 0.44372 3.04183
159 5GT9 NAP 0.001089 0.41739 3.04183
160 1K3T BRZ 0.000976 0.4107 3.06407
161 5GZ6 NDP 0.00004575 0.50589 3.06748
162 5GZ6 7C3 0.00007586 0.48725 3.06748
163 1PL6 NAD 0.000003835 0.55281 3.08989
164 1PL6 572 0.00003605 0.46687 3.08989
165 3LRE ADP 0.02911 0.40307 3.09859
166 3WCS MAN NAG 0.02879 0.41277 3.14961
167 3OJO NAD 0.000000268 0.59015 3.15789
168 2G5C NAD 0.000003068 0.51655 3.15789
169 1X14 NAD 0.0001333 0.50017 3.15789
170 2IXB NAD 0.00001984 0.48209 3.15789
171 1LJ8 NAD 0.000222 0.47175 3.15789
172 4L8V NAP 0.00005413 0.46942 3.15789
173 1M2W NAD 0.0004755 0.4538 3.15789
174 1U8X NAD 0.00043 0.44497 3.15789
175 2IXB A2G 0.00003616 0.43671 3.15789
176 4A0S NAP 0.0003694 0.43485 3.15789
177 4CP8 MLI 0.02029 0.42284 3.15789
178 3EGI ADP 0.03285 0.40967 3.15789
179 2I4O ATP 0.02444 0.40859 3.15789
180 1YQT ADP 0.03961 0.40678 3.15789
181 4USQ FAD 0.0009431 0.40637 3.15789
182 1XPJ TLA 0.03796 0.40154 3.1746
183 2Q1S NAI 0.000391 0.449 3.18302
184 1E3I CXF 0.00001908 0.45625 3.19149
185 1DMH MCT 0.0413 0.40045 3.21543
186 3QJ4 FAD 0.0005076 0.40032 3.21637
187 4NTD FAD 0.0004481 0.40024 3.23529
188 1HYH NAD 0.0000001425 0.56182 3.23625
189 3OFK SAH 0.01435 0.40599 3.24074
190 3VYW SAM 0.009989 0.40386 3.24675
191 5BSH PRO 0.0001893 0.44064 3.2491
192 1CF2 NAP 0.000008557 0.47777 3.2641
193 1RM4 NDP 0.00003431 0.46032 3.2641
194 2HK9 ATR 0.00005818 0.54159 3.27273
195 2HK9 NAP 0.00009342 0.47134 3.27273
196 3WBF NAP 0.000005091 0.51254 3.27869
197 3WBF API 0.0000112 0.47969 3.27869
198 1YJQ NAP 0.00004031 0.45959 3.30033
199 1P77 ATR 0.00003361 0.56907 3.30882
200 9LDB NAD 0.0000002215 0.55469 3.31325
201 9LDT NAD 0.0000002276 0.55426 3.31325
202 4IDC NDP 0.0002073 0.44715 3.31325
203 4IDC 1XX 0.0002073 0.44715 3.31325
204 3LZW FAD 0.0001159 0.42091 3.31325
205 1GZF NIR 0.02642 0.41478 3.31754
206 4IF4 BEF 0.02672 0.41528 3.36538
207 5BW4 SAM 0.005355 0.42589 3.37079
208 1XCL SAH 0.0006282 0.42197 3.40426
209 1E5Q NDP 0.00002595 0.48534 3.42105
210 1Y8Q ATP 0.0001119 0.47604 3.42105
211 1YKF NAP 0.00004284 0.47326 3.42105
212 1NPD NAD 0.0006581 0.44432 3.42105
213 3GGO ENO 0.00001061 0.44184 3.42105
214 3GGO NAI 0.00001061 0.44184 3.42105
215 5TUF FAD 0.0007823 0.4181 3.42105
216 4DMG SAM 0.02819 0.40183 3.42105
217 1LTH NAD 0.000000413 0.57629 3.44828
218 3W9F I3P 0.000637 0.51288 3.46154
219 2FZW NAD 0.00004331 0.41602 3.48525
220 1ZQ9 SAM 0.0008029 0.45974 3.50877
221 2YY7 NAD 0.0001907 0.44553 3.52564
222 2DUR MAN MAN 0.03083 0.41014 3.55731
223 2AJH MET 0.0353 0.40212 3.57143
224 5VKT NAP 0.0004216 0.43571 3.59116
225 4MDH NAD 0.00001523 0.49839 3.59281
226 1I0Z NAI 0.000001781 0.52547 3.6036
227 5MDH NAD 0.00001926 0.4944 3.6036
228 1O5I NAD 0.006799 0.41432 3.61446
229 1CER NAD 0.00001042 0.50923 3.62538
230 1O6Z NAD 0.00000242 0.54465 3.63036
231 5JE8 NAD 0.0000006143 0.56356 3.64238
232 3DMH SAM 0.008905 0.40604 3.67454
233 3Q3C NAD 0.00004154 0.49377 3.67893
234 1MV8 NAD 0.000002056 0.53726 3.68421
235 1MUU NAD 0.000002743 0.53725 3.68421
236 2NVK NAP 0.00241 0.47037 3.68421
237 1DLJ NAI 0.000007342 0.41673 3.68421
238 3AB1 FAD 0.0001424 0.41089 3.68421
239 2GJP MAL 0.04031 0.40537 3.68421
240 3FG2 FAD 0.001316 0.40525 3.68421
241 1DLJ UGA 0.00002383 0.4031 3.68421
242 5D4V SAH 0.0002762 0.4677 3.73134
243 3VGL BGC 0.01447 0.42437 3.73832
244 1EZ4 NAD 0.000001002 0.54967 3.77358
245 2JL1 NAP 0.003725 0.41935 3.83275
246 1G0N NDP 0.0007735 0.43193 3.88693
247 1G0N PHH 0.001013 0.43077 3.88693
248 1GAD NAD 0.00003323 0.48919 3.93939
249 1C1X NAD 0.000001911 0.53853 3.94737
250 1CDO NAD 0.00004518 0.48389 3.94737
251 1VKO NAD 0.00001824 0.47774 3.94737
252 3L9W AMP 0.0003106 0.43765 3.94737
253 3L9W GSH 0.0006321 0.43204 3.94737
254 4CNK FAD 0.0003995 0.40336 3.94737
255 1YB5 NAP 0.0001557 0.43544 3.9886
256 1ORR NAD 0.001149 0.40814 4.03458
257 1TB4 PEJ 0.0009461 0.42243 4.04313
258 4U7W NDP 0.002581 0.41121 4.04762
259 5T9F NAP 0.00004241 0.44462 4.05904
260 5T9F TYR 0.00003871 0.44146 4.05904
261 4CJX NAP 0.001735 0.42385 4.07523
262 1ZH8 NAP 0.0002102 0.43256 4.11765
263 1Z82 NDP 0.001198 0.42426 4.1791
264 5AYV NAP 0.000002687 0.54814 4.20712
265 5AYV KPL 0.00002278 0.45857 4.20712
266 2A92 NAI 0.000005531 0.49674 4.21053
267 3LAD FAD 0.000147 0.46445 4.21053
268 1OBB NAD 0.0004218 0.45228 4.21053
269 1FWV SGA MAG FUC 0.005588 0.45113 4.21053
270 1T26 NAI 0.000004871 0.45007 4.21053
271 4K5S FAD 0.0001664 0.43765 4.21053
272 1QMG APX 0.004573 0.4125 4.21053
273 3O8M GLC 0.0222 0.41072 4.21053
274 3O8M BGC 0.0222 0.41072 4.21053
275 1REO FAD 0.0002393 0.40578 4.21053
276 3SSO SAH 0.009601 0.40461 4.21053
277 4E13 NAD 0.000006788 0.542 4.24028
278 1T5C ADP 0.02412 0.41352 4.29799
279 5ITV NAI 0.002637 0.40309 4.31373
280 1IZC PYR 0.02687 0.42022 4.42478
281 3GEG NAD 0.004336 0.40239 4.45344
282 1KYQ NAD 0.0000002773 0.6243 4.47368
283 1SOW NAD 0.00000102 0.52317 4.47368
284 1DJN ADP 0.00001411 0.51791 4.47368
285 1GQ2 NAP 0.00001033 0.50073 4.47368
286 3NTD FAD 0.0008855 0.42968 4.47368
287 2DKH FAD 0.0004311 0.42271 4.47368
288 1NVM NAD 0.000009639 0.49375 4.48718
289 2Q0L NAP 0.0003613 0.48503 4.50161
290 3GFB NAD 0.0000009095 0.54624 4.57143
291 1YQD NAP 0.0001804 0.4371 4.64481
292 2DC1 NAD 0.00001547 0.49812 4.66102
293 1E7S NAP 0.003358 0.40047 4.6729
294 5J60 FAD 0.0002517 0.40117 4.6875
295 3WLE NAD 0.000005285 0.47384 4.69208
296 1VM6 NAD 0.00001501 0.50737 4.73684
297 1X87 NAD 0.00005315 0.49374 4.73684
298 1KOL NAD 0.000005633 0.4742 4.73684
299 5MQ6 NDP 0.0003438 0.45971 4.73684
300 3ULK NDP 0.0005177 0.45602 4.73684
301 1WPQ NAD 0.0004643 0.45423 4.73684
302 4EIP FAD 0.0008951 0.43598 4.73684
303 4EIP K2C 0.001078 0.43476 4.73684
304 1RM0 NAI 0.00001867 0.42188 4.73684
305 3A06 NDP 0.0004647 0.41802 4.73684
306 3A06 FOM 0.0005367 0.4084 4.73684
307 1RM0 D6P 0.00003194 0.40566 4.73684
308 3GMB FAD 0.001239 0.40245 4.73684
309 3DAG FEG 0.00006679 0.44179 4.7486
310 4HXY NDP 0.001175 0.41615 4.79452
311 1VL0 NAI 0.004562 0.40684 4.79452
312 5T9E NAP 0.00004111 0.48552 4.79705
313 5X20 NAD 0.00002028 0.50208 4.80769
314 5F5N NAD 0.0026 0.41386 4.84429
315 2HJR APR 0.0000007177 0.5722 4.87805
316 1H5Q NAP 0.002609 0.40576 4.90566
317 1OMO NAD 0.00000191 0.54888 4.96894
318 1V59 NAD 0.0001514 0.51433 5
319 1VI2 NAD 0.0001547 0.47846 5
320 1VJT NAD 0.0009328 0.45271 5
321 1GY8 NAD 0.001563 0.41155 5
322 2X3N FAD 0.0004434 0.40519 5
323 1SZ2 BGC 0.02888 0.41269 5.12048
324 1J5P NAD 0.0000008546 0.54729 5.13834
325 4M52 FAD 0.0001212 0.40388 5.15021
326 5N2I NAP 0.00003479 0.51107 5.17241
327 1DIG L37 0.001957 0.40033 5.22876
328 3VPH NAD 0.000001555 0.50991 5.26316
329 3VPH OXM 0.000002402 0.49164 5.26316
330 1BZL FAD 0.0009594 0.46503 5.26316
331 3GD4 NAD 0.0003764 0.45806 5.26316
332 1Q19 SSC 0.01187 0.43287 5.26316
333 2O07 MTA 0.002653 0.41075 5.26316
334 4ISS TAR 0.04118 0.40864 5.26316
335 1LOX RS7 0.02182 0.40062 5.26316
336 5UAV NDP 0.000003893 0.47888 5.2795
337 5UAV TFB 0.000003893 0.47888 5.2795
338 4MP8 NAD 0.0000008248 0.49499 5.30973
339 5FI3 NAP 0.0001116 0.45753 5.32213
340 2AG8 NAP 0.00003344 0.51182 5.32319
341 4NON GDP 0.0292 0.40462 5.38462
342 1F8F NAD 0.00006161 0.48255 5.39084
343 2I3G NAP 0.00003277 0.47398 5.39773
344 5KKA 6V0 0.000006196 0.49468 5.44872
345 1XHC FAD 0.000281 0.41549 5.44959
346 3LU1 NAD 0.002264 0.4081 5.49451
347 1A5Z NAD 0.0000003837 0.58986 5.52632
348 2HMT NAI 0.00004688 0.50063 5.52632
349 1KEV NDP 0.00001559 0.46969 5.52632
350 4XQC NAD 0.0000009935 0.46495 5.52632
351 4XQC 13D 0.0000009444 0.46123 5.52632
352 5VN0 NAI 0.0004612 0.44376 5.52632
353 3G5S FAD 0.0002087 0.41532 5.52632
354 5VN0 FAD 0.0004808 0.40498 5.52632
355 3OA2 NAD 0.00002292 0.48742 5.66038
356 1C3V NDP 0.000001884 0.52011 5.71429
357 1UJ5 5RP 0.03067 0.4 5.72687
358 1WDK NAD 0.000004872 0.53729 5.78947
359 1LUA NAP 0.0004658 0.46196 5.78947
360 2BRY FAD 0.00019 0.44857 5.78947
361 3H2B SAH 0.01413 0.40013 5.91133
362 2Q46 NAP 0.00226 0.41076 5.92885
363 3S5W NAP 0.002013 0.44975 6.05263
364 3S5W FAD 0.0005812 0.42753 6.05263
365 3LXD FAD 0.0008855 0.42606 6.05263
366 1JWY ADP 0.01559 0.41468 6.05263
367 3M89 GSP 0.01906 0.41033 6.05263
368 2NCD ADP 0.04416 0.40329 6.05263
369 1EJ0 SAM 0.002756 0.43544 6.11111
370 5JBX MLI 0.03405 0.40883 6.13027
371 2AE2 NAP 0.005131 0.40245 6.15385
372 1D1T NAD 0.000006971 0.4928 6.16622
373 1LCK GLU GLY GLN PTR GLN PRO GLN PRO ALA 0.01157 0.41733 6.28571
374 5H81 NAP 0.000008145 0.53313 6.31579
375 5THQ NDP 0.001861 0.41132 6.31579
376 4RQU NAD 0.000007509 0.50605 6.4
377 2CUL FAD 0.0005382 0.41001 6.46552
378 1YS4 NAP 0.000769 0.44868 6.49718
379 1O94 ADP 0.00002307 0.5043 6.5625
380 4JK3 NAD 0.0000001124 0.58747 6.56371
381 4J4H 1J1 0.0000009289 0.4526 6.56371
382 4J4H NAI 0.0000009289 0.4526 6.56371
383 1V8B NAD 0.0000006724 0.50454 6.57895
384 4OOE NDP 0.0007094 0.43632 6.57895
385 2QA1 FAD 0.000146 0.4301 6.57895
386 5M67 3D1 0.000007642 0.42535 6.57895
387 5M67 NAD 0.000008512 0.42436 6.57895
388 5M67 ADE 0.000008865 0.42376 6.57895
389 4EUE NAI 0.002124 0.4023 6.57895
390 3Q9N COA 0.00555 0.40074 6.57895
391 3H4V NAP 0.0008609 0.42399 6.59722
392 2Q1W NAD 0.0005231 0.42436 6.60661
393 2GN3 MMA 0.04849 0.40396 6.74603
394 3NJ4 NAD 0.0000512 0.52853 6.84211
395 3NJ4 AFX 0.0001391 0.50945 6.84211
396 4W6Z 8ID 0.00001544 0.45914 6.84211
397 3R51 MMA 0.01607 0.40089 6.875
398 4KOA NDP 0.000269 0.48606 6.90691
399 4RVU NDP 0.001581 0.40007 6.92771
400 1P0F NAP 0.00002789 0.47105 6.97051
401 2VYN NAD 0.00000454 0.51445 7.10526
402 1RP0 AHZ 0.0000723 0.45534 7.10526
403 1ZEM NAD 0.0003797 0.44711 7.10526
404 1Z45 NAD 0.001188 0.4187 7.10526
405 4ZRN NAD 0.0008966 0.40787 7.10526
406 3RFV NAI 0.001789 0.41745 7.11611
407 3RFV 15L 0.002229 0.41653 7.11611
408 1W73 NAP 0.002497 0.42044 7.28477
409 1W8D NAP 0.003367 0.41508 7.28477
410 4GKV NAD 0.000003716 0.4901 7.44048
411 4YSX FAD 0.000159 0.40773 7.44681
412 3H8V ATP 0.000007364 0.55213 7.53425
413 1TDF NAP 0.009881 0.41126 7.59494
414 1TDF FAD 0.005708 0.4062 7.59494
415 2EWM NAD 0.003147 0.40023 7.63052
416 2FR1 NDP 0.0006614 0.42142 7.63158
417 2D5A COA 0.001801 0.42951 7.63889
418 4USR FAD 0.00136 0.41647 7.75623
419 3GRU AMP 0.002589 0.42289 7.79661
420 5L95 AMP 0.00003595 0.51556 7.8853
421 2PV7 NAD 0.00000254 0.5288 7.89474
422 1CZA GLC 0.02572 0.41129 7.89474
423 2VT3 ATP 0.00000008428 0.67519 7.90698
424 3B1F NAD 0.000006164 0.5383 7.93103
425 2C29 NAP 0.003781 0.40215 8.01187
426 4B7X NAP 0.0006099 0.41749 8.03571
427 4JBI NDP 0.0002206 0.46012 8.10811
428 2F1K NAP 0.000002739 0.53231 8.1579
429 1UP7 NAD 0.0001869 0.46303 8.1579
430 4XZ3 COA 0.0001238 0.47833 8.26087
431 2ZJ1 ARJ 0.0000227 0.40644 8.42105
432 2ZJ1 NAD 0.00002547 0.40559 8.42105
433 1DRV A3D 0.00004004 0.50355 8.42491
434 1BW9 NAD 0.000001314 0.567 8.42697
435 1BXG NAD 0.00000154 0.54226 8.42697
436 1E3W NAD 0.002573 0.406 8.42912
437 2V6G NAP 0.002183 0.40614 8.51648
438 3QV1 NAD 0.000007181 0.52033 8.53659
439 1I9G SAM 0.01148 0.4012 8.57143
440 3WV8 ATP 0.000003825 0.5588 8.68421
441 4TXI FAD 0.0002382 0.43671 8.68421
442 3DXY SAM 0.006713 0.43287 8.68421
443 2WHX ADP 0.04508 0.40257 8.68421
444 1EOC 4NC 0.0321 0.40251 8.71369
445 4QS9 BGC 0.008478 0.43648 8.94737
446 1JAY NAP 0.0001236 0.48263 8.96226
447 3ORF NAD 0.0001466 0.45644 9.16335
448 3FUU ADN 0.006238 0.41599 9.22509
449 2AHR NAP 0.003316 0.40182 9.26641
450 4JJF FE9 0.00008236 0.46973 9.30233
451 4JJF N2I 0.0001216 0.45612 9.30233
452 3EGV SAH 0.01516 0.40488 9.44882
453 2NXE SAM 0.01586 0.40085 9.44882
454 4XDY NAI 0.00007878 0.47428 9.47368
455 5MSO NAP 0.004279 0.40524 9.47368
456 4K28 NAD 0.0000006646 0.56217 9.66543
457 2PK3 A2R 0.002919 0.43068 9.73684
458 5E5U MLI 0.00008004 0.58234 9.84848
459 3AD8 NAD 0.0001385 0.43573 9.85222
460 4PLT OXM 0.000002249 0.42145 9.96979
461 4PLT NAI 0.000002284 0.41545 9.96979
462 5EOW FAD 0.0007273 0.41059 10
463 2YVJ NAI 0.00001534 0.53767 10.0917
464 1VHZ APR 0.03829 0.40443 10.101
465 1E6E FAD 0.0006538 0.40352 10.1562
466 3ICC NAP 0.001757 0.40584 10.1961
467 1XTP SAI 0.01328 0.40437 10.2362
468 4G74 FAD 0.0002447 0.41907 10.2632
469 1NYT NAP 0.0001323 0.46912 10.3321
470 1JG3 ADN 0.003918 0.4285 10.6383
471 5T52 NGA 0.02983 0.40791 10.7438
472 2CDU ADP 0.000007803 0.55722 10.7895
473 2VHW NAI 0.0000002868 0.51643 10.7895
474 1BXK NAD 0.0005744 0.43364 10.7895
475 2CDU FAD 0.0001139 0.42855 10.7895
476 2NU8 COA 0.000003787 0.52671 11.5789
477 1H2B NAJ 0.000004347 0.49355 11.9777
478 5O4J PJL 0.0003638 0.42588 12.4088
479 5O4J SAH 0.0003599 0.42169 12.4088
480 5O4J 9KH 0.0003599 0.42169 12.4088
481 2YYY NAP 0.0003231 0.44325 12.5364
482 2V3B FAD 0.0002635 0.4135 12.6316
483 1NV8 MEQ 0.004118 0.40327 12.6316
484 1WP4 NDP 0.00001109 0.50378 13.1488
485 2CVZ NDP 0.00006295 0.47816 13.1488
486 1I36 NAP 0.00001669 0.51485 13.1579
487 3OND NAD 0.000003174 0.43711 13.4211
488 3OND ADN 0.000003174 0.43711 13.4211
489 4TSK NDP 0.0003601 0.44803 13.6842
490 1JA9 NDP 0.0009562 0.4152 14.2336
491 4II2 ATP 0.0001455 0.48399 15.3374
492 2BMZ XLM 0.01088 0.40224 15.6028
493 2BGM NAJ 0.0006052 0.43906 16.187
494 4J36 FAD 0.0001155 0.44312 16.5789
495 3ICS ADP 0.0000006984 0.6298 17.3684
496 3ICT ADP 0.0000007985 0.62692 17.3684
497 3ICR FAD 0.001223 0.42315 17.3684
498 2GAG NAD 0.0002087 0.41701 18.1818
499 1LSS NAD 0.00003833 0.50924 22.8571
500 3BAZ NAP 0.00000000005742 0.72665 24.4737
501 4E5N NAD 0.0000000006129 0.64983 24.7368
502 2NAD NAD 0.000000001329 0.6009 27.3684
503 2GCG NDP 0.000000005186 0.62755 27.8788
504 1SC6 NAD 0.00000003546 0.57559 28.4211
505 4XYB NDP 0.000000001234 0.61063 28.9474
506 4ZGS NAD 0.00000000002232 0.65406 29.4737
507 5OFW 9TW 0.000009907 0.60802 30.0448
508 1J49 NAD 0.0000000000169 0.72315 30.2632
509 2GSD NAD 0.000000001239 0.60147 30.5263
510 5DN9 NAD 0.00000000004528 0.66965 32.4176
511 5N53 8NB 0.00001309 0.5968 32.8205
512 1HKU NAD 0.000000000002643 0.7378 33.1579
513 1DXY NAD 0.00000000001301 0.74404 33.9339
514 2DBZ NAP 0.00000000002001 0.72033 36.5269
515 3KB6 NAD 0.000000000003932 0.75595 41.6168
Pocket No.: 2; Query (leader) PDB : 2O4C; 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: 2o4c.bio1) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 2O4C; Ligand: TLA; 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: 2o4c.bio1) has 5 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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