Receptor
PDB id Resolution Class Description Source Keywords
1XG5 1.53 Å EC: 1.-.-.- STRUCTURE OF HUMAN PUTATIVE DEHYDROGENASE MGC4172 IN COMPLEX HOMO SAPIENS SHORT CHAIN DEHYDROGENASE HUMAN SGC STRUCTURAL GENOMICS STRUCTURAL GENOMICS CONSORTIUM OXIDOREDUCTASE
Ref.: STRUCTURAL GENOMICS CONSORTIUM: STRUCTURE OF THE PU HUMAN DEHYDROGENASE MGC4172 TO BE PUBLISHED
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACY A:1401;
C:1402;
D:1403;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
60.052 C2 H4 O2 CC(=O...
NAP A:1301;
B:1302;
C:1303;
D:1304;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1XG5 1.53 Å EC: 1.-.-.- STRUCTURE OF HUMAN PUTATIVE DEHYDROGENASE MGC4172 IN COMPLEX HOMO SAPIENS SHORT CHAIN DEHYDROGENASE HUMAN SGC STRUCTURAL GENOMICS STRUCTURAL GENOMICS CONSORTIUM OXIDOREDUCTASE
Ref.: STRUCTURAL GENOMICS CONSORTIUM: STRUCTURE OF THE PU HUMAN DEHYDROGENASE MGC4172 TO BE PUBLISHED
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 280 families.
1 1XG5 - NAP C21 H28 N7 O17 P3 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 247 families.
1 1XG5 - NAP C21 H28 N7 O17 P3 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 177 families.
1 1XG5 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAP; Similar ligands found: 127
No: Ligand ECFP6 Tc MDL keys Tc
1 NAP 1 1
2 NA0 0.881356 0.986301
3 TAP 0.872881 0.934211
4 NDO 0.840336 0.972603
5 NAD 0.811966 0.986111
6 N01 0.733871 0.958904
7 A3D 0.712 0.972603
8 NBP 0.707692 0.935065
9 NAD IBO 0.688 0.921053
10 NHD 0.68254 0.958904
11 NJP 0.661417 0.972973
12 NAJ PYZ 0.659091 0.898734
13 NFD 0.658915 0.934211
14 DND 0.619048 0.959459
15 NXX 0.619048 0.959459
16 ZID 0.605839 0.972603
17 NAQ 0.59854 0.922078
18 ATR 0.59292 0.917808
19 NAE 0.591241 0.946667
20 NDE 0.58042 0.986301
21 A22 0.571429 0.958904
22 AMP NAD 0.571429 0.933333
23 NAJ 0.567164 0.986111
24 A2R 0.563025 0.932432
25 NDC 0.561644 0.922078
26 NA7 0.552846 0.907895
27 ODP 0.551471 0.935065
28 A2P 0.539823 0.930556
29 8ID 0.537313 0.910256
30 NAD BBN 0.525974 0.865854
31 NPW 0.525547 0.8875
32 CNA 0.521739 0.959459
33 NZQ 0.521739 0.910256
34 NAD CJ3 0.519231 0.835294
35 NDP 0.514493 0.922078
36 PO4 PO4 A A A A PO4 0.503937 0.930556
37 DG1 0.503401 0.922078
38 1DG 0.503401 0.922078
39 NAD TDB 0.5 0.696078
40 TXP 0.5 0.922078
41 NMN AMP PO4 0.492958 0.921053
42 XNP 0.492958 0.875
43 25L 0.492308 0.958904
44 25A 0.492063 0.972222
45 NAD NDT 0.490909 0.747368
46 NMN 0.486726 0.888889
47 NGD 0.485714 0.935065
48 2AM 0.477876 0.891892
49 ADP 0.458333 0.945205
50 PAP 0.451613 0.931507
51 ADP MG 0.45082 0.906667
52 BEF ADP 0.447154 0.883117
53 ADP BEF 0.447154 0.883117
54 A2D 0.445378 0.945205
55 AN2 0.442623 0.932432
56 ADP PO3 0.44 0.944444
57 SAP 0.44 0.896104
58 AGS 0.44 0.896104
59 M33 0.439024 0.906667
60 AR6 AR6 0.438849 0.945205
61 BA3 0.438017 0.945205
62 ATP MG 0.436508 0.906667
63 ADP BMA 0.43609 0.92
64 OAD 0.43609 0.92
65 ATP 0.435484 0.945205
66 OOB 0.435115 0.958904
67 B4P 0.434426 0.945205
68 AP5 0.434426 0.945205
69 GAP 0.433071 0.92
70 0WD 0.432432 0.922078
71 5FA 0.432 0.945205
72 2A5 0.432 0.87013
73 AQP 0.432 0.945205
74 00A 0.428571 0.909091
75 CA0 0.427419 0.92
76 ALF ADP 0.426357 0.871795
77 ADP ALF 0.426357 0.871795
78 ACP 0.424 0.92
79 NAJ PZO 0.423841 0.897436
80 9SN 0.423358 0.897436
81 VO4 ADP 0.423077 0.932432
82 ANP MG 0.423077 0.896104
83 ADP VO4 0.423077 0.932432
84 WAQ 0.422222 0.884615
85 ACQ 0.421875 0.92
86 V3L 0.421875 0.945205
87 ADQ 0.421053 0.92
88 AR6 0.420635 0.918919
89 APR 0.420635 0.918919
90 ATP A A A 0.42029 0.958333
91 CO7 0.419753 0.786517
92 1ZZ 0.419118 0.841463
93 3OD 0.419118 0.92
94 DLL 0.41791 0.958904
95 AD9 0.417323 0.92
96 NAX 0.416667 0.875
97 OVE 0.416667 0.857143
98 MYR AMP 0.416058 0.841463
99 AV2 0.415385 0.868421
100 A3P 0.414634 0.944444
101 NNR 0.414414 0.72973
102 ALF ADP 3PG 0.413793 0.8625
103 OMR 0.413793 0.831325
104 LA8 ALF 3PG 0.413793 0.8625
105 ANP 0.410853 0.92
106 A1R 0.410448 0.860759
107 ABM 0.409836 0.893333
108 AMP 0.408333 0.944444
109 A 0.408333 0.944444
110 SON 0.408 0.933333
111 PPS 0.407692 0.829268
112 5AL 0.407692 0.932432
113 TYR AMP 0.407143 0.933333
114 NAI 0.406897 0.909091
115 7D3 0.406504 0.857143
116 DAL AMP 0.406015 0.932432
117 ADX 0.404762 0.829268
118 ATF 0.40458 0.907895
119 3UK 0.404412 0.945946
120 AMP DBH 0.404255 0.894737
121 139 0.402685 0.875
122 AMP MG 0.401639 0.893333
123 50T 0.401575 0.906667
124 SRP 0.401515 0.907895
125 A A 0.40146 0.972222
126 FA5 0.4 0.933333
127 3AM 0.4 0.90411
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1XG5; Ligand: NAP; Similar sites found: 444
This union binding pocket(no: 1) in the query (biounit: 1xg5.bio2) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4YGM URA 0.01616 0.42452 1.2931
2 3B1F NAD 0.0001361 0.42165 1.43369
3 5T9F TYR 0.0004404 0.44009 1.47601
4 5T9F NAP 0.0005459 0.43529 1.47601
5 5T9E NAP 0.00139 0.40231 1.47601
6 2B4R NAD 0.0007008 0.42451 1.79211
7 3I6I NDP 0.0001693 0.41841 1.79211
8 1X87 NAD 0.000198 0.4176 1.79211
9 3SQP FAD 0.02972 0.41675 1.79211
10 5KDX GAL TNR 0.03505 0.41239 1.79211
11 2B4R AES 0.001417 0.41059 1.79211
12 1T26 NAI 0.004301 0.40738 1.79211
13 4G74 FAD 0.003341 0.40535 1.79211
14 4G74 UQ5 0.006812 0.40401 1.79211
15 1ZH8 NAP 0.001525 0.4036 1.79211
16 4L8V NAP 0.002164 0.40337 2.07715
17 1H9A NAP 0.0001175 0.45786 2.15054
18 4OOE NDP 0.000551 0.44068 2.15054
19 1VKO NAD 0.0008646 0.41711 2.15054
20 4RLQ 3SK 0.02401 0.41702 2.15054
21 2HQM FAD 0.002939 0.41382 2.15054
22 2G5C NAD 0.001682 0.40766 2.15054
23 1NAA ABL 0.009483 0.40221 2.15054
24 4OPC PGT 0.03351 0.40148 2.15054
25 4OPC FDA 0.02902 0.40148 2.15054
26 1NAA 6FA 0.006951 0.40017 2.15054
27 2VDV SAM 0.002327 0.45109 2.43902
28 5XVQ SAH 0.002537 0.42327 2.50896
29 3VPH NAD 0.001023 0.42111 2.50896
30 3NJ4 NAD 0.01717 0.41731 2.50896
31 3NJ4 AFX 0.01767 0.41675 2.50896
32 5JJR SAH 0.008581 0.41302 2.50896
33 4RPL 3UC 0.008328 0.41257 2.50896
34 1RSG FAD 0.00324 0.41217 2.50896
35 3VPH OXM 0.002149 0.41147 2.50896
36 3LZW NAP 0.009473 0.40508 2.50896
37 3LZW FAD 0.003875 0.40508 2.50896
38 4AP3 NAP 0.01042 0.40475 2.50896
39 1SAY PYR 0.003226 0.40359 2.50896
40 2RGJ FAD 0.003517 0.40096 2.50896
41 5MW4 5JU 0.003974 0.40017 2.50896
42 2PZM UDP 0.00003946 0.48788 2.86738
43 2PZM NAD 0.00003946 0.48788 2.86738
44 5LD5 NAD 0.0007102 0.44648 2.86738
45 3BAZ NAP 0.000877 0.43586 2.86738
46 4MDH NAD 0.0009717 0.42782 2.86738
47 1PL6 572 0.0006376 0.42745 2.86738
48 1LTH NAD 0.000159 0.42693 2.86738
49 2JJQ SAH 0.008048 0.42499 2.86738
50 1U1I NAD 0.0008769 0.42494 2.86738
51 3G2O SAM 0.004984 0.42375 2.86738
52 5XVK SAH 0.002716 0.42202 2.86738
53 1PL6 NAD 0.0001185 0.41861 2.86738
54 1LLU NAD 0.00141 0.41716 2.86738
55 1GAD NAD 0.0006798 0.41396 2.86738
56 3H9E NAD 0.0008261 0.41049 2.86738
57 5MDH NAD 0.000978 0.40892 2.86738
58 1YQZ FAD 0.008464 0.40776 2.86738
59 4AT0 FAD 0.006204 0.40562 2.86738
60 5UAO FAD 0.004882 0.40123 2.86738
61 5AYV KPL 0.004197 0.40044 2.86738
62 1HDR NAD 0.00002769 0.49969 2.86885
63 1XFF GLU 0.02599 0.4036 2.91667
64 1O6Z NAD 0.0001782 0.42312 2.9703
65 1OC2 NAD 0.0000142 0.5176 3.22581
66 2BH9 NAP 0.0001297 0.50607 3.22581
67 5MPT SAH 0.0002933 0.47958 3.22581
68 3CMC NAD 0.001399 0.44392 3.22581
69 3CIF NAD 0.0003573 0.42888 3.22581
70 3V1Y NAD 0.0003413 0.42427 3.22581
71 1J0X NAD 0.00173 0.42379 3.22581
72 3CIF G3H 0.001854 0.41389 3.22581
73 1LVL NAD 0.006281 0.41267 3.22581
74 4BWL MN9 0.03273 0.41143 3.22581
75 1DSS NAD 0.0006027 0.4108 3.22581
76 1V8B NAD 0.003214 0.40599 3.22581
77 5E58 CPZ 0.03462 0.40583 3.22581
78 4D04 NAP 0.0109 0.40524 3.22581
79 5FJN BE2 0.006325 0.40357 3.22581
80 5FJN FAD 0.005387 0.40357 3.22581
81 1OC2 TDX 0.0000142 0.40203 3.22581
82 3TWO NDP 0.003813 0.40202 3.22581
83 1PN0 FAD 0.007683 0.40194 3.22581
84 1PN0 IPH 0.008057 0.40194 3.22581
85 1FEC FAD 0.00732 0.40193 3.22581
86 1R37 NAD 0.003754 0.4011 3.22581
87 3M89 GSP 0.0295 0.40085 3.22581
88 4YMH SAH 0.007092 0.40448 3.33333
89 3RFV NAI 0.000003724 0.49912 3.37079
90 3RFV 15L 0.00003036 0.46077 3.37079
91 1YS4 NAP 0.00007838 0.42772 3.38983
92 4Z3E GAL NGA GLA BGC GAL 0.02433 0.41955 3.53535
93 2IXB NAD 0.0002245 0.44289 3.58423
94 5UAV TFB 0.0003984 0.44049 3.58423
95 5UAV NDP 0.0003984 0.44049 3.58423
96 1Q0H NDP 0.001333 0.43206 3.58423
97 1Q0H FOM 0.00139 0.42947 3.58423
98 5H81 NAP 0.002736 0.42509 3.58423
99 1KOL NAD 0.001205 0.42221 3.58423
100 1WP4 NDP 0.0007704 0.41387 3.58423
101 1G55 SAH 0.009078 0.40872 3.58423
102 2IXB A2G 0.0003324 0.40849 3.58423
103 4CJX NAP 0.005403 0.40385 3.58423
104 1H6C SIN 0.005011 0.40183 3.58423
105 1K3T BRZ 0.003403 0.4015 3.58423
106 1RYD NDP 0.004552 0.40133 3.58423
107 5L95 AMP 0.0003961 0.46924 3.75
108 3B1J NAD 0.000701 0.42161 3.83481
109 3B20 NAD 0.001027 0.401 3.83481
110 5GVR LMR 0.04415 0.42545 3.84615
111 5DOZ NDP 0.002122 0.40916 3.84615
112 1HDO NAP 0.000003322 0.51626 3.8835
113 4HXY NDP 0.0000000131 0.60037 3.94265
114 2F1K NAP 0.0001611 0.46192 3.94265
115 1UWK URO 0.0002234 0.46065 3.94265
116 1UWK NAD 0.0002234 0.46065 3.94265
117 4RDH AMP 0.005364 0.4296 3.94265
118 1GV0 NAD 0.0004395 0.42857 3.94265
119 1H2B NAJ 0.000861 0.42393 3.94265
120 2NAD NAD 0.001037 0.42345 3.94265
121 1CF2 NAP 0.0005413 0.41621 3.94265
122 5KVS NAP 0.003402 0.4149 3.94265
123 4RQU NAD 0.001366 0.40823 3.94265
124 1PJS NAD 0.00008286 0.40796 3.94265
125 4XQC NAD 0.000115 0.40663 3.94265
126 4XQC 13D 0.00009751 0.4059 3.94265
127 5GM1 SAH 0.006831 0.40517 3.94265
128 2BRY FAD 0.002748 0.40499 3.94265
129 4D79 ATP 0.001689 0.44509 3.98551
130 3O5X JZG 0.01352 0.41777 3.98551
131 1JNR FAD 0.01526 0.40503 4
132 2DC1 NAD 0.0003726 0.42548 4.23729
133 2DT5 NAD 0.001135 0.42227 4.2654
134 5MSO NAP 0.0000002207 0.53611 4.30108
135 1R6D NAD 0.000006426 0.52935 4.30108
136 1R6D DAU 0.000006153 0.52901 4.30108
137 4OHU NAD 0.0000001162 0.45063 4.30108
138 4OHU 2TK 0.0000001162 0.45063 4.30108
139 5THY SAH 0.001625 0.4383 4.30108
140 3OA2 NAD 0.0004422 0.438 4.30108
141 1GUZ NAD 0.0006341 0.41968 4.30108
142 3L4S 3PG 0.001598 0.41384 4.30108
143 3L4S NAD 0.001487 0.4137 4.30108
144 1HYH NAD 0.00155 0.41168 4.30108
145 3ABI NAD 0.000002743 0.51838 4.38356
146 1CER NAD 0.0001566 0.46241 4.53172
147 4NEC SAH 0.001756 0.45256 4.54545
148 1E7S NAP 0.0000001093 0.56818 4.6595
149 1EK6 UPG 0.000005211 0.53515 4.6595
150 1GY8 NAD 0.000002651 0.51459 4.6595
151 2EXX NAP 0.00006154 0.46846 4.6595
152 1UXG NAD 0.0001901 0.4553 4.6595
153 3GGO ENO 0.000493 0.4429 4.6595
154 3GGO NAI 0.000493 0.4429 4.6595
155 3WGT QSC 0.001905 0.42682 4.6595
156 3WGT FAD 0.001808 0.42682 4.6595
157 3WLE NAD 0.001071 0.42416 4.6595
158 3JV7 NAD 0.0008665 0.42388 4.6595
159 1EK6 NAI 0.000002837 0.42206 4.6595
160 1P0F NAP 0.001152 0.41785 4.6595
161 3OND NAD 0.004302 0.41192 4.6595
162 3OND ADN 0.004302 0.41192 4.6595
163 1RM4 NDP 0.001261 0.40671 4.6595
164 1UXG FUM 0.01894 0.40461 4.6595
165 2A92 NAI 0.003202 0.40124 4.6729
166 5FTW SAH 0.001688 0.43759 4.6875
167 1J5P NAD 0.0007106 0.41472 4.74308
168 3A4V NAD 0.0000001796 0.56774 5.01792
169 4GLL NAD 0.000001193 0.5294 5.01792
170 3A4V PYR 0.0000001796 0.52617 5.01792
171 1I2B NAD 0.00002523 0.50655 5.01792
172 4KP7 NAP 0.001026 0.43655 5.01792
173 5JE8 NAD 0.0009258 0.4349 5.01792
174 1GTE FAD 0.003012 0.42676 5.01792
175 3WQQ IB3 0.001441 0.42484 5.01792
176 3WQQ NDP 0.001441 0.42484 5.01792
177 1LDN NAD 0.0007502 0.42341 5.01792
178 1I2B UPG 0.0176 0.41825 5.01792
179 1I2B USQ 0.0176 0.41825 5.01792
180 4KP7 1UQ 0.003108 0.41385 5.01792
181 1BZL FAD 0.01512 0.41338 5.01792
182 1U3U BNF 0.003206 0.41235 5.01792
183 5JCM NAD 0.01444 0.40146 5.09978
184 5JCM FAD 0.01395 0.40146 5.09978
185 4EUE NAI 0.0000001793 0.56015 5.26316
186 4U7W NDP 0.00000003368 0.6022 5.37634
187 2C5A NAD 0.0000001802 0.59159 5.37634
188 1UDB NAD 0.00001058 0.51851 5.37634
189 5F8F SFG 0.001509 0.45567 5.37634
190 2C5A GDC 0.0000001802 0.45216 5.37634
191 1HDG NAD 0.0006006 0.44251 5.37634
192 2DFV NAD 0.000271 0.43015 5.37634
193 1NVM NAD 0.001031 0.41828 5.37634
194 3UCL NAP 0.01177 0.40693 5.37634
195 3UCL CYH 0.01135 0.40577 5.37634
196 3UCL FAD 0.01135 0.40577 5.37634
197 3ORF NAD 0.0000004223 0.53547 5.57769
198 3I9U DTU 0.03119 0.40328 5.70342
199 4O1M NAD 0.0000000617 0.57067 5.73477
200 1ORR NAD 0.0000006162 0.54201 5.73477
201 1Z45 NAD 0.000001185 0.53216 5.73477
202 3GFB NAD 0.0005713 0.43684 5.73477
203 2FZW NAD 0.002466 0.41777 5.73477
204 1D1T NAD 0.001191 0.4173 5.73477
205 1D4D FAD 0.004899 0.40612 5.73477
206 2DVZ GLU 0.03055 0.40361 5.73477
207 2R0D 4IP 0.04283 0.40343 5.73477
208 3KO8 NAD 0.0000001219 0.56641 6.09319
209 4PIV NDP 0.000003225 0.51143 6.09319
210 1EQ2 NAP 0.000005001 0.5002 6.09319
211 5KKA 6V0 0.0001536 0.45056 6.09319
212 1E5Q NDP 0.0001168 0.44732 6.09319
213 4DMG SAM 0.007133 0.43156 6.09319
214 2GSD NAD 0.0009555 0.42481 6.09319
215 4J36 1HR 0.002297 0.41898 6.09319
216 4J36 FAD 0.001296 0.41726 6.09319
217 2WPF WPF 0.01497 0.41443 6.09319
218 4YCA NDP 0.003625 0.40811 6.09319
219 1GR0 NAD 0.002585 0.40723 6.09319
220 3P13 RIP 0.04638 0.40842 6.25
221 2Y6Q FAD 0.003264 0.40093 6.28141
222 2Y6Q I7T 0.007963 0.40048 6.28141
223 5ULP KB1 0.003757 0.41312 6.34328
224 2VHW NAI 0.00175 0.41604 6.36605
225 5J6Y GLC 0.02112 0.42055 6.38298
226 5J6Y BGC 0.02112 0.42055 6.38298
227 2Q1S NAI 0.000008998 0.51293 6.45161
228 1WVG APR 0.000002922 0.49311 6.45161
229 1BW9 NAD 0.0007509 0.44912 6.45161
230 1SOW NAD 0.0006819 0.42636 6.45161
231 1C1X NAD 0.001822 0.42001 6.45161
232 3A06 FOM 0.001792 0.41565 6.45161
233 3A06 NDP 0.001554 0.41556 6.45161
234 5KOK SAH 0.007603 0.41215 6.45161
235 1Y8Q ATP 0.003998 0.412 6.45161
236 1Q8A HCS 0.03159 0.41034 6.45161
237 5X2N ALA 0.03003 0.40907 6.45161
238 3LST SAH 0.01942 0.40639 6.45161
239 1BXG NAD 0.001126 0.40406 6.45161
240 4XYB NDP 0.001286 0.40293 6.45161
241 4DPL NAP 0.0001528 0.45238 6.81004
242 5CAE COA 0.001562 0.42884 6.81004
243 1YB5 NAP 0.0007272 0.42801 6.81004
244 3QVP FAD 0.006923 0.40024 6.81004
245 1RPN NDP 0.000002393 0.48788 6.86567
246 4J4H NAI 0.005434 0.40704 6.94981
247 4J4H 1J1 0.005434 0.40704 6.94981
248 4JK3 NAD 0.001449 0.40142 6.94981
249 4Q9N NAI 0.00000002999 0.58699 7.16846
250 2DBZ NAP 0.0004112 0.42675 7.16846
251 1HYE NAP 0.0002574 0.41486 7.16846
252 4XZ3 COA 0.001774 0.42979 7.3913
253 2FR1 NDP 0.00000009823 0.56992 7.40741
254 2BKA NDP 0.0000002935 0.54025 7.43802
255 1RKX NAD 0.0000001787 0.55816 7.52688
256 2XVE FAD 0.003902 0.42218 7.52688
257 2XVF FAD 0.002782 0.40951 7.52688
258 1D7O NAD 0.000001256 0.49239 7.8853
259 4RSL FAD 0.0009163 0.40076 7.8853
260 5IL1 SAM 0.006676 0.41798 8.01887
261 5JAQ NAI 0.00001294 0.50145 8.24373
262 2PV7 NAD 0.001501 0.40299 8.24373
263 2Q46 NAP 0.00000004459 0.57055 8.3004
264 4TQG NDP 0.00000001683 0.58647 8.35913
265 3QV1 NAD 0.0002963 0.42146 8.53659
266 3SSO SAH 0.004606 0.40426 8.60215
267 2EV9 NAP 0.002789 0.40349 8.74525
268 1N7G NDP 0.000008636 0.53753 8.92388
269 1N7G GDR 0.000007911 0.52785 8.92388
270 1ZMD NAI 0.002184 0.4198 8.96057
271 3ZNN FAD 0.004931 0.41589 8.96057
272 3ZNN 4WL 0.004931 0.41589 8.96057
273 2E5V FAD 0.005048 0.40561 8.96057
274 2Z9I GLY ALA THR VAL 0.02533 0.41835 9.25926
275 1BXK NAD 0.0000002947 0.54134 9.319
276 1KEW TYD 0.000008398 0.52138 9.319
277 1KEW NAD 0.000009142 0.52103 9.319
278 1EZ4 NAD 0.0008463 0.43327 9.319
279 3VYW SAM 0.003957 0.42144 9.319
280 1E1M FAD 0.003472 0.41975 9.319
281 1E1M NAP 0.003472 0.41975 9.319
282 5DN9 NAD 0.0007706 0.41445 9.319
283 5FA5 MTA 0.01193 0.41311 9.319
284 4D3F NAP 0.0004515 0.40603 9.67742
285 1HKU NAD 0.00262 0.40319 10.3943
286 3OFK SAH 0.007325 0.41957 10.6481
287 2C29 NAP 0.000002595 0.53401 10.7527
288 2C29 DQH 0.000007849 0.51525 10.7527
289 2X6T NAP 0.000004984 0.50029 10.7527
290 3MJE NDP 0.000000008118 0.60322 10.8871
291 3TLJ SAH 0.005187 0.41319 11.1111
292 1V35 NAI 0.0000001799 0.57615 11.828
293 2I3G NAP 0.00006221 0.46363 11.828
294 3AD8 FAD 0.009189 0.41019 12.1212
295 3LU1 NAD 0.000000182 0.56292 12.1864
296 1Y1P NMN AMP PO4 0.000004244 0.5398 12.1864
297 4ZRN NAD 0.0000004912 0.52131 12.1864
298 4ZRN UPG 0.000001563 0.44326 12.1864
299 1V6A TRE 0.001449 0.48469 12.5448
300 9LDB NAD 0.0002905 0.43873 12.5448
301 9LDT NAD 0.0003074 0.43782 12.5448
302 3KB6 NAD 0.0008162 0.41264 12.5448
303 1VQW FAD 0.002511 0.40646 12.5448
304 2GVC FAD 0.003195 0.40253 12.5448
305 2GV8 FAD 0.003752 0.40111 12.5448
306 2Q1W NAD 0.000001063 0.53126 12.9032
307 5IN4 NAP 0.00007895 0.53403 12.9121
308 5IN4 6CK 0.00007745 0.53403 12.9121
309 5IN4 GDP 0.0001017 0.52789 12.9121
310 4R5M 4NO 0.002301 0.40529 13.2616
311 4R5M NAP 0.001724 0.40454 13.2616
312 4GKV NAD 0.000393 0.43809 13.6905
313 5TVA AMP 0.03378 0.40137 13.75
314 4PVD NDP 0.0000001515 0.54142 13.9785
315 2GZ3 NAP 0.00008489 0.48039 13.9785
316 1LDM NAD 0.0005474 0.43142 13.9785
317 1I0Z NAI 0.000411 0.42993 13.9785
318 4QTU SAM 0.002023 0.43776 16.2963
319 3O26 NDP 0.00000000002529 0.69447 17.2043
320 2YY7 NAD 0.0000001975 0.55654 17.2043
321 1QG6 TCL 0.00000004386 0.60316 18.3908
322 1QG6 NAD 0.00000004386 0.60316 18.3908
323 5L4S NAP 0.000000000593 0.66425 18.9964
324 5L4S 6KX 0.000000000593 0.66425 18.9964
325 5L53 NAP 0.000000003266 0.57173 20.0717
326 5M67 ADE 0.003711 0.41532 20.4301
327 5M67 NAD 0.003991 0.41407 20.4301
328 5M67 3D1 0.004233 0.41305 20.4301
329 5HJM MTA 0.01197 0.40336 20.7885
330 1E6E FAD 0.004215 0.4015 21.0938
331 4W6Z 8ID 0.00173 0.41623 21.147
332 5CG1 NAD BBN 0.0000009358 0.41614 22.2222
333 3OIG NAD 0.00000001229 0.58509 23.3083
334 1SB8 UD2 0.000001567 0.55276 25.448
335 1SB8 NAD 0.00000184 0.54511 25.448
336 4J1Q NDP 0.0000001105 0.55351 26.8817
337 5E8J SAH 0.001423 0.46142 27.2727
338 3RJ5 NAD 0.000000002651 0.64142 30.315
339 1W8D NAP 0.0000000005445 0.61233 30.466
340 1W73 NAP 0.0000000006538 0.6097 30.466
341 2PD4 DCN 0.0000000573 0.5847 30.9091
342 2PD4 NAD 0.00000006106 0.58366 30.9091
343 4FC7 NAP 0.000000009638 0.62714 31.4079
344 4FC7 COA 0.000000009638 0.62714 31.4079
345 1W6U NAP 0.0000000004042 0.61691 31.8996
346 3H4V DVP 0.00000002267 0.6127 31.8996
347 3H4V NAP 0.0000000534 0.59659 31.8996
348 1G0N PHH 0.00000000002506 0.72559 32.2581
349 1G0N NDP 0.00000000002206 0.72114 32.2581
350 1XSE NDP 0.000000000004368 0.75275 32.6165
351 4D42 NAP 0.00000003715 0.61498 32.6165
352 4D42 W0I 0.00000003715 0.61498 32.6165
353 3AFN NAP 0.0000000000158 0.71437 33.7209
354 1OAA OAA 0.00000000002344 0.73085 33.9768
355 1E6W NAD 0.00000000002046 0.71222 35
356 3ZV6 NAD 0.000000000008294 0.7442 35.1254
357 3ZV6 4HB 0.000000000009421 0.7442 35.1254
358 4K26 SFF 0.00000000002886 0.7189 35.1449
359 4K26 NDP 0.00000000001394 0.71094 35.1449
360 1E3W NAD 0.00000000001868 0.69898 35.249
361 1U7T TDT 0.0000000001559 0.69483 35.249
362 1U7T NAD 0.00000000005924 0.66639 35.249
363 1A27 NAP 0.00000000002539 0.69426 35.8423
364 1GZ6 NAI 0.00000007658 0.57185 35.8423
365 3HB5 NAP 0.0000000007847 0.52658 35.8423
366 2GDZ NAD 0.0000000000005124 0.75588 36.7041
367 2AE2 NAP 0.0000000000004874 0.78953 37.3077
368 2AE2 PTO 0.0000000000004874 0.66734 37.3077
369 4J7U NAP 0.0000000000154 0.73591 37.6344
370 4J7U YTZ 0.0000000000154 0.73591 37.6344
371 3CH6 NAP 0.00000000002572 0.75678 38.7097
372 3CH6 311 0.00000000002572 0.75678 38.7097
373 3O03 NAP 0.000000003552 0.59857 38.7097
374 1XHL NDP 0.0000000000003383 0.77407 39.0681
375 2WYV NAD 0.000004287 0.5034 39.0805
376 1WMA AB3 0.00000000101 0.66707 39.4265
377 1N5D NDP 0.0000000004495 0.65483 39.4265
378 3OJF IMJ 0.00000002085 0.61242 39.4265
379 3OJF NDP 0.00000001776 0.60397 39.4265
380 1WMA NDP 0.00000000101 0.54952 39.4265
381 1Z6Z NAP 0.000000000003698 0.7248 40.1434
382 3V1U NAD 0.0000000000426 0.65493 40.1434
383 4QED NAP 0.0000000002488 0.65831 40.3226
384 1X1T NAD 0.000000000007148 0.7273 40.3846
385 1FK8 NAD 0.00000000002319 0.66573 40.4669
386 2VZ0 NAP 0.0000001113 0.62166 40.6716
387 2VZ0 D64 0.0000001113 0.62166 40.6716
388 2WD7 NAP 0.000000005893 0.60211 40.6716
389 1ZEM NAD 0.0000000002868 0.63562 40.8397
390 3WXB NDP 0.00000000002368 0.70238 40.8602
391 2DKN NAI 0.000000000001051 0.73635 41.5686
392 2DTX BMA 0.000000000003873 0.75246 41.6667
393 2B4Q NAP 0.000000000001667 0.73747 41.6667
394 3QWI CUE 0.0000000001041 0.70162 41.8519
395 3QWI NAP 0.00000000003127 0.7006 41.8519
396 1XKQ NDP 0.0000000000001023 0.79654 41.9355
397 1ZBQ NAD 0.0000000108 0.60574 41.9355
398 5ITV NAI 0.000000000006624 0.72296 41.9608
399 1AE1 NAP 0.0000000000001429 0.79109 42.1245
400 3NUG NAD 0.0000000001237 0.67568 42.915
401 1UZN NAP 0.0000004109 0.4721 42.915
402 3AY6 BGC 0.0000000003263 0.69674 43.1227
403 3AY6 NAI 0.00000000008421 0.69662 43.1227
404 2Q2V NAD 0.000000000003233 0.74023 43.1373
405 3VZS NAP 0.00000004478 0.60438 43.1907
406 3VZS CAA 0.0000003085 0.41915 43.1907
407 2CFC NAD 0.0000000000008855 0.73829 43.2
408 4ZA2 NAD 0.00000000005967 0.67467 43.4783
409 1H5Q NAP 0.0000000001239 0.67564 43.7736
410 3ICC NAP 0.000000000001132 0.75446 43.9216
411 2RH4 EMO 0.00000000001612 0.74119 44.0433
412 2WSB NAD 0.00000000002232 0.7254 44.0945
413 1NFQ NAI 0.000000000003207 0.73756 44.6154
414 1PR9 NAP 0.0000000000001312 0.79247 44.6721
415 3D3W NAP 0.000000000000239 0.78269 44.6721
416 3OID NDP 0.00000000008223 0.68747 44.9612
417 4CLO NAP 0.000000003418 0.64104 45.5197
418 4CM8 NAP 0.000000003629 0.63351 45.5197
419 4CME NAP 0.000000004063 0.63162 45.5197
420 4CM4 NAP 0.000000004741 0.62904 45.5197
421 3JQF NAP 0.00000000339 0.62832 45.5197
422 4CMI NAP 0.000000005989 0.62515 45.5197
423 4CM9 NAP 0.000000002856 0.61902 45.5197
424 3BMQ NAP 0.000000003326 0.61698 45.5197
425 3JQ8 NAP 0.000000004195 0.61287 45.5197
426 3BMN NAP 0.00000000464 0.61144 45.5197
427 3BMO NAP 0.000000004458 0.60644 45.5197
428 4CLR NAP 0.000000004535 0.60617 45.5197
429 3JQ9 NAP 0.00000000827 0.60259 45.5197
430 3JQG NAP 0.000000007799 0.59214 45.5197
431 3JQB NAP 0.00000001027 0.58802 45.5197
432 3SJ7 NDP 0.0000000000705 0.67102 45.6349
433 1ZK4 NAP 0.00000000102 0.65313 45.8167
434 3JQA NAP 0.000000005377 0.63335 45.8781
435 3JQ7 NAP 0.00000001288 0.61851 45.8781
436 4CQM NAP 0.00000000003865 0.68748 45.9016
437 1GEE NAD 0.00000000009788 0.68653 45.977
438 1VL8 NAP 0.00000000009916 0.66009 46.0674
439 1GEG NAD 0.000000000002536 0.74651 46.0938
440 2BD0 NAP 0.00000000000005784 0.80273 46.3115
441 1Q7B NAP 0.00000000421 0.62476 47.1311
442 4NBT NAD 0.000000000001986 0.72651 47.5
443 1O5I NAD 0.000000004285 0.54993 48.1928
444 3RKR NAP 0.00000002743 0.47224 48.855
445 2ZAT NAP 0.00000000001631 0.70175 50
Pocket No.: 2; Query (leader) PDB : 1XG5; Ligand: NAP; 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: 1xg5.bio2) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1XG5; Ligand: NAP; 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: 1xg5.bio2) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1XG5; Ligand: NAP; 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: 1xg5.bio2) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1XG5; Ligand: NAP; 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: 1xg5.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 1XG5; Ligand: NAP; 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: 1xg5.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 1XG5; Ligand: NAP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 1xg5.bio1) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 1XG5; Ligand: NAP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 1xg5.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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