Receptor
PDB id Resolution Class Description Source Keywords
4U7W 1.9 Å NON-ENZYME: OTHER THE CRYSTAL STRUCTURE OF THE TERMINAL R DOMAIN FROM THE MYXA NRPS BIOSYNTHETIC PATHWAY STIGMATELLA AURANTIACA REDUCTASE THIOESTERASE ROSSMANN FOLD POLYKETIDE NON-RIBOPEPTIDE POLYKETIDE SYNTHASE NON-RIBOSOMAL PEPTIDE SYNTHETSHORT-CHAIN DEHYDROGENASES OXIDOREDUCTASE
Ref.: COMPREHENSIVE STRUCTURAL AND BIOCHEMICAL ANALYSIS O TERMINAL MYXALAMID REDUCTASE DOMAIN FOR THE ENGINEE PRODUCTION OF PRIMARY ALCOHOLS. CHEM.BIOL. V. 22 1018 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NDP B:1601;
A:1601;
Valid;
Valid;
none;
none;
Kd = 45 uM
745.421 C21 H30 N7 O17 P3 c1nc(...
ACT B:1602;
A:1602;
Invalid;
Invalid;
none;
none;
submit data
59.044 C2 H3 O2 CC(=O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4U7W 1.9 Å NON-ENZYME: OTHER THE CRYSTAL STRUCTURE OF THE TERMINAL R DOMAIN FROM THE MYXA NRPS BIOSYNTHETIC PATHWAY STIGMATELLA AURANTIACA REDUCTASE THIOESTERASE ROSSMANN FOLD POLYKETIDE NON-RIBOPEPTIDE POLYKETIDE SYNTHASE NON-RIBOSOMAL PEPTIDE SYNTHETSHORT-CHAIN DEHYDROGENASES OXIDOREDUCTASE
Ref.: COMPREHENSIVE STRUCTURAL AND BIOCHEMICAL ANALYSIS O TERMINAL MYXALAMID REDUCTASE DOMAIN FOR THE ENGINEE PRODUCTION OF PRIMARY ALCOHOLS. CHEM.BIOL. V. 22 1018 2015
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 4U7W Kd = 45 uM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1068 families.
1 4U7W Kd = 45 uM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 922 families.
1 4U7W Kd = 45 uM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NDP; Similar ligands found: 159
No: Ligand ECFP6 Tc MDL keys Tc
1 NDP 1 1
2 0WD 0.827273 1
3 NAI 0.803738 0.986842
4 NMN AMP PO4 0.794643 0.948052
5 NPW 0.692308 0.962025
6 NZQ 0.686441 0.987013
7 DG1 0.68 1
8 1DG 0.68 1
9 A2R 0.650943 0.909091
10 A22 0.64486 0.934211
11 TXP 0.644628 0.924051
12 ATR 0.640777 0.894737
13 NA7 0.636364 0.886076
14 XNP 0.620968 0.949367
15 AP0 0.598361 0.948718
16 A2P 0.598039 0.881579
17 NJP 0.574803 0.923077
18 25L 0.550847 0.934211
19 ODP 0.550388 0.936709
20 NAX 0.544 0.949367
21 25A 0.53913 0.921053
22 2AM 0.529412 0.87013
23 6V0 0.519685 0.974026
24 NAP 0.514493 0.922078
25 EAD 0.507143 0.949367
26 A2D 0.504673 0.921053
27 TXE 0.503876 0.935897
28 NA0 0.496454 0.910256
29 TXD 0.496124 0.911392
30 SAP 0.495575 0.875
31 AGS 0.495575 0.875
32 P1H 0.493056 0.925926
33 CO7 0.489796 0.791209
34 TAP 0.489362 0.864198
35 PAP 0.482456 0.907895
36 BA3 0.481818 0.921053
37 NAJ PZO 0.478261 0.924051
38 ATP 0.477876 0.921053
39 B4P 0.477477 0.921053
40 ADP 0.477477 0.921053
41 AP5 0.477477 0.921053
42 OAD 0.47541 0.897436
43 5FA 0.473684 0.921053
44 AR6 0.473684 0.896104
45 APR 0.473684 0.896104
46 AQP 0.473684 0.921053
47 AN2 0.473214 0.909091
48 3OD 0.467742 0.897436
49 50T 0.464912 0.884615
50 PO4 PO4 A A A A PO4 0.463415 0.857143
51 V3L 0.461538 0.896104
52 2A5 0.46087 0.85
53 A1R 0.459016 0.841463
54 ADQ 0.459016 0.897436
55 4AD 0.459016 0.875
56 OVE 0.458716 0.8375
57 OMR 0.458647 0.813953
58 PPS 0.457627 0.811765
59 AD9 0.456897 0.897436
60 CA0 0.45614 0.897436
61 M33 0.45614 0.884615
62 ADJ 0.455882 0.879518
63 A3P 0.455357 0.894737
64 ACP 0.452174 0.897436
65 ENP 0.451613 0.85
66 UP5 0.451128 0.948052
67 SRP 0.45 0.8625
68 ANP 0.449153 0.897436
69 ACQ 0.449153 0.897436
70 PRX 0.448276 0.82716
71 5AL 0.445378 0.884615
72 7D4 0.443478 0.8375
73 ADX 0.443478 0.811765
74 AMP 0.436364 0.894737
75 A 0.436364 0.894737
76 4TC 0.433824 0.924051
77 7D3 0.433628 0.8375
78 ETB 0.433566 0.797753
79 DCA 0.433566 0.788889
80 1ZZ 0.433071 0.802326
81 BIS 0.433071 0.864198
82 00A 0.432 0.864198
83 ATF 0.429752 0.886076
84 0T1 0.427586 0.788889
85 5SV 0.427419 0.788235
86 8QN 0.427419 0.884615
87 3AM 0.427273 0.857143
88 N01 0.426573 0.884615
89 PR8 0.425197 0.811765
90 WAQ 0.425197 0.841463
91 LAD 0.425197 0.821429
92 DTP 0.425 0.8375
93 AMO 0.424 0.886076
94 PAJ 0.424 0.843373
95 APC 0.423729 0.886076
96 UPA 0.423358 0.935897
97 48N 0.422222 0.853659
98 FYA 0.421875 0.860759
99 PTJ 0.421875 0.853659
100 CNA 0.421429 0.910256
101 PUA 0.42069 0.9125
102 NXX 0.419118 0.910256
103 DND 0.419118 0.910256
104 AV2 0.418033 0.848101
105 COA 0.417808 0.788889
106 3UK 0.417323 0.897436
107 OOB 0.416 0.909091
108 IVC 0.415584 0.78022
109 DAT 0.415254 0.8375
110 NDO 0.414966 0.897436
111 139 0.414286 0.901235
112 3AT 0.413223 0.896104
113 TAT 0.413223 0.886076
114 YLB 0.413043 0.784091
115 62F 0.4125 0.823529
116 ABM 0.412281 0.848101
117 YAP 0.412214 0.875
118 YLP 0.411765 0.784091
119 ME8 0.410853 0.802326
120 NB8 0.410853 0.853659
121 SON 0.410256 0.886076
122 DLL 0.409449 0.909091
123 AHX 0.409449 0.853659
124 COS 0.409396 0.771739
125 AMX 0.409396 0.797753
126 CAO 0.409396 0.763441
127 30N 0.409396 0.72449
128 7D5 0.409091 0.8125
129 4UW 0.408759 0.9125
130 APX 0.407692 0.841463
131 SRA 0.40708 0.85
132 CMX 0.406667 0.788889
133 SCO 0.406667 0.788889
134 TYM 0.405797 0.886076
135 COD 0.405594 0.777778
136 OXK 0.405229 0.771739
137 CA6 0.405229 0.70297
138 A12 0.405172 0.886076
139 AP2 0.405172 0.886076
140 9SN 0.40458 0.853659
141 LAQ 0.404412 0.802326
142 T5A 0.404255 0.914634
143 FAM 0.403974 0.771739
144 ACO 0.403974 0.763441
145 FCX 0.403974 0.763441
146 AMP MG 0.403509 0.825
147 VO4 ADP 0.403226 0.860759
148 ADP VO4 0.403226 0.860759
149 YLC 0.402878 0.823529
150 1VU 0.402597 0.763441
151 FA5 0.401515 0.886076
152 HAX 0.401316 0.771739
153 APU 0.4 0.923077
154 TXA 0.4 0.886076
155 A U 0.4 0.898734
156 4UU 0.4 0.948052
157 AFH 0.4 0.843373
158 CAJ 0.4 0.771739
159 AR6 AR6 0.4 0.871795
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4U7W; Ligand: NDP; Similar sites found: 339
This union binding pocket(no: 1) in the query (biounit: 4u7w.bio1) has 29 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5L53 NAP 0.0000003519 0.53285 1.23457
2 1MUU NAD 0.003214 0.40887 1.42857
3 1MV8 NAD 0.004076 0.402 1.42857
4 5M67 NAD 0.01082 0.40343 1.66667
5 5M67 ADE 0.0117 0.40201 1.66667
6 5M67 3D1 0.01207 0.40145 1.66667
7 1LUA NAP 0.0009691 0.44366 1.74216
8 2F1K NAP 0.002729 0.40359 1.79211
9 4K28 NAD 0.003736 0.40625 1.85874
10 1V8B NAD 0.005204 0.40522 1.90476
11 2YRX AMP 0.03459 0.40512 1.90476
12 2V6G NAP 0.0000008955 0.51935 1.92308
13 5LD5 NAD 0.003278 0.41445 1.95531
14 3RJ5 NAD 0.00000004931 0.51858 1.9685
15 1TI7 NAP 0.001713 0.43302 1.98864
16 5T2U NAP 0.0000000005884 0.67581 2.01613
17 3NUG NAD 0.000000005542 0.59721 2.02429
18 3B20 NAD 0.001764 0.42238 2.0649
19 4YAG NAI 0.000001235 0.459 2.07612
20 4B7X NAP 0.004391 0.40468 2.08333
21 4E5N NAD 0.003664 0.40525 2.12121
22 3OND ADN 0.01022 0.40365 2.14286
23 3OND NAD 0.01022 0.40365 2.14286
24 4K26 NDP 0.00000001063 0.58631 2.17391
25 4K26 SFF 0.00000004475 0.51091 2.17391
26 1EZ4 NAD 0.0007385 0.42487 2.20126
27 5JAQ NAI 0.0002703 0.46031 2.21675
28 3T7S SAM 0.01313 0.4008 2.23881
29 1IY8 NAD 0.00000004148 0.59866 2.24719
30 3EB9 FLC 0.005237 0.4342 2.25564
31 3GFB NAD 0.0008777 0.42509 2.28571
32 2NAD NAD 0.002407 0.41744 2.29008
33 3TWO NDP 0.004021 0.40856 2.29885
34 4JGP PYR 0.03295 0.40682 2.30415
35 2DFV NAD 0.001017 0.42262 2.30548
36 1NFQ NAI 0.00000002794 0.60756 2.30769
37 1O6Z NAD 0.0009218 0.41296 2.31023
38 1W73 NAP 0.000000004514 0.64966 2.31788
39 1W8D NAP 0.000000004549 0.60788 2.31788
40 1JAY NAP 0.001015 0.40411 2.35849
41 2DBZ NAP 0.0003483 0.4356 2.39521
42 2GCG NDP 0.0006255 0.43232 2.42424
43 2VDV SAM 0.01811 0.40416 2.43902
44 3CH6 311 0.00000001986 0.65645 2.44755
45 3CH6 NAP 0.00000001986 0.65645 2.44755
46 5TWJ SAM 0.007904 0.40748 2.46914
47 1LDN NAD 0.0009056 0.42901 2.53165
48 2HK9 ATR 0.01373 0.4176 2.54545
49 3NJ4 AFX 0.02549 0.41556 2.61905
50 3NJ4 NAD 0.02549 0.41556 2.61905
51 1ZEM NAD 0.00000002373 0.60729 2.67176
52 4MDH NAD 0.0001475 0.45494 2.69461
53 5MDH NAD 0.0001454 0.45517 2.7027
54 2DM6 IMN 0.005823 0.40642 2.7027
55 3OJF NDP 0.000003632 0.47851 2.72374
56 3OJF IMJ 0.000003674 0.45185 2.72374
57 1NE7 AGP 0.005086 0.43063 2.76817
58 1E5Q NDP 0.0002106 0.44393 2.85714
59 3G5N PB2 0.03247 0.40557 2.85714
60 2C5A GDC 0.00000003811 0.4481 2.90237
61 2C5A NAD 0.00000003811 0.4481 2.90237
62 3EVG SAH 0.008697 0.40886 2.90909
63 1HYH NAD 0.001529 0.40398 2.91262
64 1XDS SAM 0.01102 0.41452 2.94118
65 1QZZ SAM 0.01286 0.4113 2.94118
66 3V1Y NAD 0.00132 0.42122 2.96736
67 2CVQ NDP 0.0005422 0.42801 3.0581
68 2WYV NAD 0.000003636 0.50496 3.06513
69 1RKX NAD 0.0000000001133 0.65672 3.08123
70 5H81 NAP 0.001165 0.43657 3.08483
71 1X87 NAD 0.0009857 0.43608 3.0853
72 1U7Z PMT 0.00519 0.40181 3.09735
73 4ZGS NAD 0.0008505 0.41535 3.10881
74 3I27 SID 0.04099 0.40096 3.125
75 1O5I NAD 0.00003154 0.51281 3.21285
76 1RYO OXL 0.02418 0.41489 3.33333
77 4DPL NAP 0.0008177 0.4172 3.34262
78 3AY6 NAI 0.00000005234 0.52387 3.34572
79 3AY6 BGC 0.0000002167 0.45165 3.34572
80 2PV7 NAD 0.001064 0.42186 3.3557
81 1ZBQ NAD 0.00000357 0.49116 3.36391
82 5U5G NAP 0.002715 0.40226 3.38983
83 4YCA NDP 0.0008545 0.42863 3.40136
84 2I3G NAP 0.001481 0.40346 3.40909
85 5GT9 NAP 0.0000002077 0.57131 3.42205
86 1QG6 NAD 0.000008245 0.52695 3.44828
87 1QG6 TCL 0.000008245 0.52695 3.44828
88 1GZ6 NAI 0.00002165 0.4692 3.44828
89 1ORR NAD 0.000000002945 0.5912 3.45821
90 2ZAT NAP 0.0000002669 0.54553 3.46154
91 4D3F NAP 0.001484 0.40117 3.54839
92 1CER NAD 0.001204 0.42279 3.57143
93 4FC7 NAP 0.00000008083 0.60758 3.61011
94 4FC7 COA 0.00000008083 0.60758 3.61011
95 1PZG A3D 0.001033 0.4345 3.62538
96 3A4T SFG 0.007556 0.40225 3.64964
97 1BW9 NAD 0.005214 0.40907 3.65169
98 2CUN 3PG 0.02409 0.406 3.65854
99 2GDZ NAD 0.0008011 0.4612 3.74532
100 4FZV SAM 0.007743 0.40478 3.76569
101 1WP4 NDP 0.002275 0.40914 3.80623
102 4PIV NDP 0.0000007578 0.52062 3.80952
103 3ABI NAD 0.0006307 0.43369 3.83562
104 3VPH NAD 0.0006502 0.43743 3.87097
105 3VPH OXM 0.002405 0.41745 3.87097
106 3ICT ADP 0.002208 0.45255 3.91156
107 4R5M NAP 0.002474 0.40918 3.98936
108 4R5M 4NO 0.00291 0.40918 3.98936
109 2O4C NAD 0.002581 0.41121 4.04762
110 2QZZ NAP 0.0007101 0.44102 4.08805
111 2QZZ EMF 0.0007601 0.44102 4.08805
112 3D3W NAP 0.00000001607 0.61916 4.09836
113 1PR9 NAP 0.000462 0.47579 4.09836
114 2GZ3 NAP 0.001653 0.43741 4.09836
115 1KEW TYD 0.000000003005 0.48767 4.15512
116 1KEW NAD 0.000000002287 0.48709 4.15512
117 4OSP NAP 0.00000001691 0.59763 4.18251
118 4OSP 2V4 0.02729 0.41041 4.18251
119 4PLG NAI 0.01506 0.41418 4.19162
120 4PLG OXM 0.01506 0.41418 4.19162
121 3CMC NAD 0.01075 0.41397 4.19162
122 3KB6 NAD 0.002725 0.40611 4.19162
123 1N7G GDR 0.000000003925 0.4662 4.19948
124 1N7G NDP 0.000000004553 0.42688 4.19948
125 2DC1 NAD 0.001203 0.4198 4.23729
126 2DC1 CIT 0.04294 0.40108 4.23729
127 1J5P NAD 0.003241 0.43234 4.34783
128 1Y1P NMN AMP PO4 0.000000005881 0.65237 4.38596
129 3QWI NAP 0.00000004689 0.55638 4.44444
130 3QWI CUE 0.0000001218 0.48781 4.44444
131 1BXK NAD 0.0000000002396 0.66612 4.50704
132 4J1Q NDP 0.0000001109 0.57529 4.52381
133 4O0L NDP 0.00000006042 0.55958 4.52381
134 3I9U DTU 0.0203 0.40671 4.56274
135 2VT3 ATP 0.001999 0.45467 4.65116
136 1FK8 NAD 0.00000007233 0.5711 4.66926
137 1VM6 NAD 0.001877 0.41819 4.82456
138 1JJV ATP 0.03798 0.40465 4.85437
139 3HAD NAD 0.007079 0.41112 4.87013
140 5IN4 NAP 0.00000001168 0.72634 4.94506
141 5IN4 GDP 0.00000001078 0.72634 4.94506
142 5IN4 6CK 0.00000001159 0.72594 4.94506
143 1YJQ NAP 0.003574 0.40821 4.9505
144 5UAV TFB 0.003105 0.41419 4.96894
145 5UAV NDP 0.003105 0.41419 4.96894
146 2PK3 A2R 0.00000006475 0.63072 4.98442
147 1LSS NAD 0.001037 0.4424 5
148 3V1U NAD 0.002223 0.43624 5
149 3A28 NAD 0.00000002747 0.58137 5.03876
150 2C29 NAP 0.0000000002886 0.54389 5.04451
151 2C29 DQH 0.000000001252 0.52662 5.04451
152 5T9E NAP 0.002814 0.40291 5.16605
153 1LLU NAD 0.002975 0.41258 5.26316
154 1XKQ NDP 0.0000000259 0.55726 5.35714
155 1XG5 NAP 0.00000003368 0.6022 5.37634
156 1XHL NDP 0.001241 0.45582 5.38721
157 3MJE NDP 0.00000001216 0.59269 5.44355
158 1GEG NAD 0.00000009171 0.56268 5.46875
159 4EUE NAI 0.00004672 0.45269 5.47619
160 2G2Y MLI 0.02778 0.41261 5.51948
161 5T9F TYR 0.0009334 0.43626 5.53506
162 5T9F NAP 0.001254 0.42992 5.53506
163 4YEE 4CQ 0.01427 0.4261 5.55556
164 1H3F TYE 0.02263 0.41672 5.55556
165 3CIF NAD 0.001219 0.42109 5.57103
166 1WDK NAD 0.004051 0.41064 5.64103
167 2JAP NDP 0.00000001062 0.58748 5.66802
168 2JAH NDP 0.00000003111 0.57162 5.66802
169 2AG5 NAD 0.000001728 0.5334 5.69106
170 2G5C NAD 0.003057 0.40419 5.69395
171 2PD4 DCN 0.00001225 0.50868 5.81818
172 2PD4 NAD 0.00001322 0.50736 5.81818
173 4NBT NAD 0.00000002685 0.58973 5.83333
174 1U1I NAD 0.0006323 0.43925 5.86735
175 5F5N NAD 0.00000005221 0.59386 5.88235
176 4ITU 1HS 0.0000002189 0.58993 5.94796
177 4ITU NAI 0.00000008852 0.58993 5.94796
178 2CUL FAD 0.001573 0.4248 5.95238
179 2CFC NAD 0.00000001442 0.6119 6
180 1J0X NAD 0.003067 0.42171 6.0241
181 4Q9N NAI 0.000006856 0.51194 6.04027
182 3GGO ENO 0.0005195 0.45113 6.05096
183 3GGO NAI 0.0005195 0.45113 6.05096
184 5CAE COA 0.001157 0.42983 6.07029
185 1OAA OAA 0.0005185 0.48563 6.17761
186 3VZS NAP 0.000000002021 0.52079 6.22568
187 3VZS CAA 0.00000001482 0.42851 6.22568
188 2WSB NAD 0.00000006997 0.60686 6.29921
189 1Z6Z NAP 0.0000001782 0.5718 6.38298
190 1RL4 BRR 0.02747 0.40619 6.38298
191 1EBF NAD 0.001216 0.4123 6.42458
192 1GUZ NAD 0.001589 0.41072 6.45161
193 1VL0 NAI 0.00000008319 0.56958 6.50685
194 1RPN NDP 0.0000000002275 0.60124 6.56716
195 5L4L NAP 0.0000005804 0.53262 6.57895
196 5L4L 7OX 0.00001392 0.50948 6.57895
197 4O1M NAD 0.000004811 0.5161 6.66667
198 1UWK NAD 0.001323 0.43863 6.66667
199 1UWK URO 0.001323 0.43863 6.66667
200 1XXR MAN 0.009671 0.43066 6.66667
201 5XVK 8GC 0.00644 0.44607 6.69014
202 1XSE NDP 0.000000001183 0.67866 6.77966
203 2DTX BMA 0.0003172 0.49067 6.81818
204 3O03 NAP 0.001687 0.44288 6.87285
205 2B4Q NAP 0.002871 0.4374 6.88406
206 1X1T NAD 0.005185 0.45845 6.90476
207 1KYQ NAD 0.002279 0.43887 6.93431
208 3H4V DVP 0.00000002514 0.62827 6.94444
209 3H4V NAP 0.0000000613 0.61085 6.94444
210 4J7U NAP 0.0000001412 0.5977 6.94444
211 4J7U YTZ 0.0000001412 0.5977 6.94444
212 1HDR NAD 0.02496 0.41379 6.96721
213 2VUT NAD 0.003519 0.41954 6.97674
214 4NBW NAD 0.00000007662 0.58148 7.00389
215 2DKN NAI 0.00000001683 0.6093 7.05882
216 3U4C NDP 0.00864 0.41552 7.11744
217 3WMX NAD 0.0000001347 0.57772 7.14286
218 1H5Q NAP 0.000000007906 0.59308 7.16981
219 5THQ NDP 0.0000000008518 0.6621 7.35294
220 5KKA 6V0 0.001262 0.42475 7.37179
221 3QV1 NAD 0.001378 0.41085 7.4184
222 2Q2V NAD 0.00000003681 0.5542 7.45098
223 3SJU NDP 0.00000001565 0.58103 7.52688
224 1OFU GDP 0.007282 0.40905 7.56302
225 4D79 ATP 0.001979 0.4377 7.6087
226 1AE1 NAP 0.00000001086 0.62587 7.69231
227 2AE2 PTO 0.000000004279 0.53799 7.69231
228 2AE2 NAP 0.000000004279 0.53799 7.69231
229 1Q7B NAP 0.00000001768 0.58767 7.78689
230 2B4R NAD 0.001584 0.41952 7.82609
231 2VZ0 D64 0.0000002303 0.62391 7.83582
232 2VZ0 NAP 0.0000002303 0.62391 7.83582
233 2WD7 NAP 0.00000002083 0.60571 7.83582
234 4FN4 NAD 0.00000007454 0.58653 7.87402
235 5JE8 NAD 0.001344 0.424 7.94702
236 3ORF NAD 0.000004678 0.50573 7.96813
237 1MXH DHF 0.00000001189 0.53385 7.97101
238 1MXH NAP 0.00000001797 0.52863 7.97101
239 3BMQ NAP 0.00000001075 0.61925 7.98611
240 4CLO NAP 0.000000009538 0.61635 7.98611
241 5K6A NAP 0.00000001422 0.61452 7.98611
242 5JDI NAP 0.00000001559 0.61059 7.98611
243 4CLR NAP 0.00000001637 0.60977 7.98611
244 3JQA NAP 0.00000001504 0.60872 7.98611
245 3JQG NAP 0.00000001518 0.60857 7.98611
246 4CM9 NAP 0.00000002168 0.60739 7.98611
247 3JQB NAP 0.00000001667 0.607 7.98611
248 3BMO NAP 0.00000001957 0.60677 7.98611
249 3JQ9 NAP 0.00000003183 0.60091 7.98611
250 4CME NAP 0.00000001622 0.59788 7.98611
251 5JDC NAP 0.00000001736 0.5967 7.98611
252 4CM4 NAP 0.00000001737 0.59666 7.98611
253 4CM8 NAP 0.00000001928 0.59503 7.98611
254 4CMI NAP 0.00000001962 0.59475 7.98611
255 5JCJ NAP 0.0000000211 0.5936 7.98611
256 3JQF NAP 0.00000001197 0.59346 7.98611
257 3JQ7 NAP 0.0000000442 0.59069 7.98611
258 3JQ8 NAP 0.00000002099 0.58483 7.98611
259 3BMN NAP 0.00000003106 0.57857 7.98611
260 3JQF AX2 0.003314 0.45478 7.98611
261 3BMN AX3 0.01219 0.42739 7.98611
262 3JQB DX6 0.02026 0.4173 7.98611
263 4CLO XP0 0.03878 0.40353 7.98611
264 4CME KTZ 0.02634 0.4033 7.98611
265 4RDH AMP 0.01613 0.40313 7.98611
266 3JQ7 DX2 0.0443 0.40212 7.98611
267 4CQM NAP 0.00000001635 0.58901 8.19672
268 1EDO NAP 0.003057 0.4681 8.19672
269 5ITV NAI 0.00000001113 0.621 8.23529
270 3I6I NDP 0.00000142 0.55081 8.3815
271 5EPO NAP 0.0000004851 0.53577 8.39695
272 4NBU NAI 0.00000001109 0.62106 8.4
273 5N2I NAP 0.0008232 0.40676 8.62069
274 3C1O NAP 0.0002587 0.43449 8.72274
275 5L4S NAP 0.0000001793 0.58524 8.80503
276 5L4S 6KX 0.0000001793 0.58524 8.80503
277 1VL8 NAP 0.000000005952 0.58117 8.98876
278 4NFE BEN 0.03594 0.40536 9.2827
279 3O26 NDP 0.00000002212 0.58525 9.32476
280 1HSL HIS 0.04159 0.40168 9.66387
281 1SC6 NAD 0.002734 0.41154 9.7619
282 4ZA2 NAD 0.0000001139 0.57714 9.88142
283 4ZRN NAD 0.0000000005096 0.60431 9.9359
284 4ZRN UPG 0.000000004913 0.4879 9.9359
285 2A92 NAI 0.001207 0.4255 9.96885
286 1HDO NAP 0.000000004246 0.57616 10.1942
287 1W6U NAP 0.00000000366 0.65336 10.2649
288 2HJR APR 0.0002301 0.43255 10.3659
289 1O5E 132 0.01793 0.40437 10.5263
290 1E7S NAP 0.0008594 0.46273 10.5919
291 1E3W NAD 0.00000003498 0.57759 10.728
292 1E6W NAD 0.00000006875 0.56638 10.7692
293 2EWM NAD 0.002696 0.43992 10.8434
294 4XB2 HSE 0.001293 0.42433 11.3433
295 4XB2 NDP 0.0004457 0.42282 11.3433
296 2DT5 NAD 0.00171 0.40983 11.3744
297 1YXM ADE 0.0006117 0.4864 11.5512
298 1U7T NAD 0.00000009421 0.57802 12.2605
299 1U7T TDT 0.000000106 0.49202 12.2605
300 4PVD NDP 0.000000000638 0.66886 12.5731
301 3GEG NAD 0.002214 0.43938 12.9555
302 2YY7 NAD 0.0000001129 0.58166 14.4231
303 1Z0N BCD 0.02733 0.41242 14.5833
304 4D42 W0I 0.000005754 0.54074 14.8936
305 4D42 NAP 0.000005754 0.54074 14.8936
306 1JA9 NDP 0.002262 0.47429 14.9635
307 3RFV NAI 0.00002258 0.52408 14.9813
308 3RFV 15L 0.0000518 0.50691 14.9813
309 1WVG APR 0.0002781 0.47427 15
310 2PZM NAD 0.0000002149 0.59177 15.1515
311 2PZM UDP 0.0000002149 0.59177 15.1515
312 3AFN NAP 0.00000001872 0.61654 15.5039
313 4GLL NAD 0.00000001506 0.6181 16.0237
314 3MMH SME 0.02553 0.40399 16.1677
315 5L95 AMP 0.001626 0.43767 16.25
316 3OID NDP 0.0000000142 0.62128 16.2791
317 2FR1 NDP 0.00000002952 0.56515 16.4286
318 1N5D NDP 0.00000002778 0.60547 16.6667
319 1WMA NDP 0.0000001537 0.48095 17.029
320 1WMA AB3 0.0000001537 0.48095 17.029
321 1Z45 NAD 0.00008626 0.50274 17.619
322 3A4V NAD 0.000000007048 0.55576 17.9811
323 3A4V PYR 0.000000007048 0.55576 17.9811
324 1OC2 NAD 0.000000001159 0.47785 18.3908
325 1OC2 TDX 0.000000001159 0.47785 18.3908
326 1GY8 NAD 0.00000001707 0.61373 21.4106
327 2BD0 NAP 0.000000001641 0.65591 22.541
328 4II2 ATP 0.006091 0.40927 22.8916
329 4TQG NDP 0.000000002916 0.63878 23.2198
330 2Q1W NAD 0.0000001757 0.53279 23.7237
331 1EQ2 NAP 0.00000002385 0.58208 24.1935
332 2CHT TSA 0.02751 0.41023 24.4094
333 1EK6 NAI 0.0000002425 0.43771 24.7126
334 1EK6 UPG 0.0000001567 0.43358 24.7126
335 2X6T NAP 0.000000002925 0.64125 26.3305
336 3LU1 NAD 0.000000002216 0.62041 29.3956
337 4R1S NAP 0.000000000006019 0.73015 31.454
338 1GEE NAD 0.000000008365 0.59957 33.3333
339 5MSO NAP 0.000000000001574 0.75303 40.4762
Pocket No.: 2; Query (leader) PDB : 4U7W; Ligand: NDP; 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: 4u7w.bio1) has 29 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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