Receptor
PDB id Resolution Class Description Source Keywords
5IN4 1.6 Å EC: 4.2.1.47 CRYSTAL STRUCTURE OF GDP-MANNOSE 4,6 DEHYDRATASE BOUND TO A BASED INHIBITOR HOMO SAPIENS GDP-MANNOSE 4 6 DEHYDRATASE ANTIBODY FUCOSYLATION LYASE-ICOMPLEX
Ref.: FACILE MODULATION OF ANTIBODY FUCOSYLATION WITH SMA MOLECULE FUCOSTATIN INHIBITORS AND COCRYSTAL STRUCT GDP-MANNOSE 4,6-DEHYDRATASE. ACS CHEM.BIOL. V. 11 2734 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GDP B:403;
D:403;
A:1002;
C:1002;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
443.201 C10 H15 N5 O11 P2 c1nc2...
6CK A:1003;
B:401;
D:401;
C:1003;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
Kd = 11 uM
643.313 C16 H22 F3 N5 O15 P2 c1nc2...
NAP C:1001;
A:1001;
D:402;
B:402;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5IN4 1.6 Å EC: 4.2.1.47 CRYSTAL STRUCTURE OF GDP-MANNOSE 4,6 DEHYDRATASE BOUND TO A BASED INHIBITOR HOMO SAPIENS GDP-MANNOSE 4 6 DEHYDRATASE ANTIBODY FUCOSYLATION LYASE-ICOMPLEX
Ref.: FACILE MODULATION OF ANTIBODY FUCOSYLATION WITH SMA MOLECULE FUCOSTATIN INHIBITORS AND COCRYSTAL STRUCT GDP-MANNOSE 4,6-DEHYDRATASE. ACS CHEM.BIOL. V. 11 2734 2016
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 5IN4 Kd = 11 uM 6CK C16 H22 F3 N5 O15 P2 c1nc2c(n1[....
2 1T2A - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
3 5IN5 Kd = 35 uM GFB C16 H25 N5 O15 P2 C[C@H]1[C@....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 5IN4 Kd = 11 uM 6CK C16 H22 F3 N5 O15 P2 c1nc2c(n1[....
2 1T2A - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
3 5IN5 Kd = 35 uM GFB C16 H25 N5 O15 P2 C[C@H]1[C@....
50% Homology Family (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1RPN - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
2 2PK3 - GDD C16 H25 N5 O16 P2 c1nc2c(n1[....
3 1N7H - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
4 1N7G - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
5 5IN4 Kd = 11 uM 6CK C16 H22 F3 N5 O15 P2 c1nc2c(n1[....
6 1T2A - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
7 5IN5 Kd = 35 uM GFB C16 H25 N5 O15 P2 C[C@H]1[C@....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GDP; Similar ligands found: 153
No: Ligand ECFP6 Tc MDL keys Tc
1 GDP 1 1
2 GTP 0.909091 1
3 GP3 0.881579 0.973684
4 GNH 0.858974 0.986667
5 GNP 0.839506 0.973684
6 G 0.828947 0.986486
7 5GP 0.828947 0.986486
8 G1R 0.82716 0.986667
9 GCP 0.82716 0.973684
10 GSP 0.817073 0.948718
11 GAV 0.797619 0.961039
12 GMV 0.792683 0.973684
13 G2P 0.77381 0.961039
14 G2R 0.770115 0.961039
15 GDP MG 0.759036 0.923077
16 GP2 0.756098 0.961039
17 GDP BEF 0.75 0.9
18 GDD 0.747253 0.961039
19 GKE 0.747253 0.961039
20 GDC 0.747253 0.961039
21 GPG 0.741573 0.961039
22 G3D 0.732558 0.986486
23 ALF 5GP 0.729412 0.888889
24 Y9Z 0.728261 0.902439
25 GTP MG 0.724138 0.923077
26 BEF GDP 0.724138 0.888889
27 G5P 0.723404 0.973684
28 GFB 0.72043 0.961039
29 GTG 0.72043 0.936709
30 GDR 0.72043 0.961039
31 G4P 0.715909 0.986486
32 GCP G 0.715909 0.935065
33 6CK 0.712766 0.936709
34 G3A 0.712766 0.973684
35 GDP ALF 0.7 0.888889
36 GDP AF3 0.7 0.888889
37 YGP 0.698925 0.901235
38 JB2 0.697917 0.961039
39 GKD 0.697917 0.961039
40 GDX 0.690722 0.973684
41 GPD 0.690722 0.925
42 GMP 0.684211 0.88
43 0O2 0.666667 0.986486
44 G G 0.659574 0.935065
45 JB3 0.656863 0.948718
46 NGD 0.650485 0.961039
47 GDP 7MG 0.636364 0.911392
48 DGI 0.636364 0.923077
49 U2G 0.634615 0.936709
50 GPX 0.634409 0.946667
51 IDP 0.632184 0.972973
52 2MD 0.632075 0.891566
53 CAG 0.62963 0.880952
54 CG2 0.622642 0.936709
55 FEG 0.619048 0.879518
56 MGD 0.614679 0.891566
57 ZGP 0.613208 0.869048
58 GH3 0.612903 0.973333
59 3GP 0.611765 0.946667
60 MD1 0.607143 0.891566
61 PGD 0.59292 0.925
62 DGT 0.591398 0.923077
63 BGO 0.588785 0.924051
64 TPG 0.582609 0.840909
65 DBG 0.582609 0.948718
66 2GP 0.574713 0.96
67 FE9 0.570175 0.776596
68 I2C FE2 CMO CMO 0.566372 0.808989
69 G A A A 0.553571 0.923077
70 MGP 0.553191 0.961039
71 U A G G 0.548673 0.935065
72 G4M 0.548387 0.880952
73 6G0 0.547368 0.961039
74 G1R G1R 0.542373 0.924051
75 P2G 0.527473 0.883117
76 PGD O 0.525 0.850575
77 ADP 0.522222 0.92
78 GGM 0.517544 0.901235
79 DG 0.516484 0.910256
80 DGP 0.516484 0.910256
81 P1G 0.516129 0.871795
82 G G U 0.509259 0.935065
83 G1G 0.508475 0.925
84 IMP 0.505495 0.959459
85 G C 0.504348 0.9
86 GPC 0.491525 0.879518
87 G7M 0.483871 0.948052
88 6AD 0.479592 0.841463
89 ATP 0.473684 0.92
90 G2Q 0.471154 0.961039
91 U G A 0.469697 0.888889
92 5FA 0.46875 0.92
93 AQP 0.46875 0.92
94 GTA 0.468468 0.936709
95 7DD 0.468085 0.906667
96 G G G RPC 0.466102 0.875
97 SGP 0.463158 0.82716
98 01G 0.462963 0.902439
99 B4P 0.457447 0.894737
100 AP5 0.457447 0.894737
101 A2D 0.456522 0.894737
102 G G G C 0.455285 0.9125
103 ACQ 0.454545 0.896104
104 5GP 5GP 0.454545 0.883117
105 ANP 0.454545 0.896104
106 A G C C 0.451613 0.911392
107 APC G U 0.45082 0.886076
108 G U34 0.449153 0.888889
109 DG DG 0.448598 0.865854
110 ITT 0.447917 0.868421
111 BA3 0.446809 0.894737
112 35G 0.444444 0.933333
113 C2E 0.444444 0.921053
114 PCG 0.444444 0.933333
115 MGO 0.441176 0.864198
116 AN2 0.4375 0.907895
117 G C C C 0.4375 0.924051
118 M33 0.43299 0.883117
119 UCG 0.429688 0.911392
120 A G U 0.42963 0.888889
121 ACP 0.428571 0.896104
122 MGQ 0.424528 0.935897
123 7DT 0.424242 0.906667
124 APR 0.424242 0.894737
125 AR6 0.424242 0.894737
126 93A 0.42268 0.833333
127 A4P 0.420168 0.869048
128 SAP 0.42 0.873418
129 AD9 0.42 0.896104
130 AGS 0.42 0.873418
131 G8D 0.42 0.875
132 CA0 0.418367 0.896104
133 ATF 0.417476 0.884615
134 AGO 0.414634 0.888889
135 NIA 0.413043 0.82716
136 MGV 0.412844 0.890244
137 TAT 0.411765 0.884615
138 A1R 0.411215 0.839506
139 ADQ 0.411215 0.871795
140 RGT 0.410714 0.909091
141 CGP 0.409836 0.86747
142 AMP 0.408602 0.893333
143 A 0.408602 0.893333
144 UP5 0.40678 0.873418
145 C2R 0.406593 0.906667
146 AMZ 0.406593 0.918919
147 JBT 0.405882 0.778947
148 A22 0.40566 0.907895
149 25L 0.405405 0.907895
150 ADX 0.40404 0.809524
151 8OD 0.401961 0.946667
152 4TC 0.4 0.851852
153 50T 0.4 0.883117
Ligand no: 2; Ligand: 6CK; Similar ligands found: 95
No: Ligand ECFP6 Tc MDL keys Tc
1 6CK 1 1
2 GDC 0.795918 0.95
3 GKE 0.795918 0.95
4 GDD 0.795918 0.95
5 GFB 0.787879 0.95
6 GDR 0.787879 0.95
7 GDX 0.757282 0.962025
8 GP3 0.73913 0.9375
9 GKD 0.730769 0.95
10 JB2 0.730769 0.95
11 GTP 0.726316 0.936709
12 G1R 0.71875 0.949367
13 GDP 0.712766 0.936709
14 GSP 0.71134 0.891566
15 GPD 0.707547 0.915663
16 JB3 0.706422 0.938272
17 GNH 0.705263 0.925
18 GCP 0.683673 0.91358
19 GNP 0.676768 0.91358
20 G2R 0.676471 0.902439
21 G 0.659574 0.924051
22 5GP 0.659574 0.924051
23 GMV 0.656566 0.91358
24 GAV 0.631068 0.902439
25 Y9Z 0.62963 0.850575
26 GP2 0.626263 0.902439
27 GTG 0.623853 0.903614
28 GPG 0.622642 0.925926
29 G3A 0.618182 0.9375
30 GDP MG 0.613861 0.86747
31 G5P 0.612613 0.9375
32 G2P 0.61165 0.902439
33 GDP BEF 0.607843 0.891566
34 ALF 5GP 0.607843 0.903614
35 BEF GDP 0.605769 0.880952
36 YGP 0.590909 0.870588
37 GTP MG 0.590476 0.86747
38 GDP AF3 0.588785 0.903614
39 GDP ALF 0.588785 0.903614
40 GCP G 0.584906 0.878049
41 0O2 0.577982 0.924051
42 G G 0.572727 0.901235
43 NGD 0.571429 0.925926
44 U2G 0.571429 0.903614
45 G4M 0.571429 0.873563
46 GMP 0.55914 0.825
47 2MD 0.557377 0.862069
48 CAG 0.556452 0.852273
49 G4P 0.555556 0.924051
50 G3D 0.551402 0.924051
51 CG2 0.54918 0.903614
52 FEG 0.545455 0.872093
53 MGD 0.544 0.862069
54 ZGP 0.540984 0.840909
55 PGD 0.539062 0.892857
56 TPG 0.530769 0.815217
57 GDP 7MG 0.529915 0.879518
58 MD1 0.527132 0.862069
59 DBG 0.519084 0.914634
60 GH3 0.518182 0.9125
61 3GP 0.509804 0.8875
62 FE9 0.507692 0.755102
63 I2C FE2 CMO CMO 0.503876 0.784946
64 U A G G 0.488372 0.901235
65 DGT 0.486486 0.86747
66 G1R G1R 0.485075 0.914634
67 GPX 0.482456 0.8875
68 2GP 0.480769 0.9
69 G A A A 0.48062 0.890244
70 ADQ 0.473684 0.864198
71 IDP 0.472222 0.911392
72 G1G 0.466165 0.892857
73 DGI 0.463636 0.86747
74 PGD O 0.459854 0.824176
75 MGP 0.455357 0.902439
76 G G U 0.451613 0.901235
77 6G0 0.451327 0.902439
78 BGO 0.449612 0.914634
79 GPC 0.440298 0.916667
80 GGM 0.439394 0.892857
81 JBT 0.438202 0.77551
82 P2G 0.431193 0.851852
83 G C 0.428571 0.869048
84 G2Q 0.428571 0.902439
85 IMP 0.425926 0.898734
86 U G A 0.425676 0.858824
87 P1G 0.423423 0.841463
88 DGP 0.422018 0.855422
89 DG 0.422018 0.855422
90 G G G RPC 0.41791 0.845238
91 GTA 0.417323 0.903614
92 G G G C 0.410072 0.880952
93 A G C C 0.407143 0.879518
94 APC G U 0.405797 0.855422
95 01G 0.4 0.872093
Ligand no: 3; 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 : 5IN4; Ligand: 6CK; Similar sites found: 263
This union binding pocket(no: 1) in the query (biounit: 5in4.bio1) has 135 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5T9E NAP 0.01895 0.43352 1.10701
2 4D3F NAP 0.03335 0.43042 1.29032
3 3CIF NAD 0.0446 0.41159 1.39276
4 5T9F TYR 0.0122 0.42264 1.47601
5 5T9F NAP 0.01408 0.42173 1.47601
6 1E3W NAD 0.000002741 0.60436 1.53257
7 1E6W NAD 0.000002327 0.60764 1.53846
8 3WXB NDP 0.000004229 0.59146 1.79211
9 4MDH NAD 0.004247 0.46227 1.79641
10 5MDH NAD 0.002012 0.47766 1.8018
11 4PIV NDP 0.00001754 0.56337 1.92308
12 3I6I NDP 0.001289 0.46168 2.02312
13 1LLU NAD 0.04796 0.40171 2.04678
14 3V1Y NAD 0.03717 0.41926 2.07715
15 2HJR APR 0.002379 0.48604 2.13415
16 4XFR CIT 0.04722 0.44262 2.1978
17 4O1M NAD 0.0002293 0.51574 2.22222
18 3O26 NDP 0.0000043 0.59535 2.2508
19 1XSE NDP 0.000008429 0.54633 2.37288
20 5L53 NAP 0.000008316 0.61471 2.46914
21 4OOE NDP 0.02162 0.43074 2.47253
22 4R5M NAP 0.02437 0.42407 2.47253
23 3OJO NAD 0.0453 0.42126 2.47253
24 4R5M 4NO 0.04196 0.40928 2.47253
25 3GGO NAI 0.02317 0.40474 2.54777
26 3GGO ENO 0.02317 0.40474 2.54777
27 5KKA 6V0 0.01913 0.42311 2.5641
28 5BXV MGP 0.03071 0.45557 2.60417
29 1NVM NAD 0.04477 0.40797 2.6087
30 3MJE NDP 0.00000792 0.58312 2.62097
31 1EJ4 M7G 0.01821 0.46286 2.63158
32 1EJH M7G 0.0408 0.44071 2.63158
33 3B20 NAD 0.03661 0.42379 2.65487
34 5DOZ NDP 0.04381 0.40507 2.66272
35 5U5G NAP 0.04552 0.41117 2.71186
36 5HV7 RBL 0.007059 0.4768 2.74725
37 1MUU NAD 0.02071 0.43388 2.74725
38 1MV8 NAD 0.02615 0.42673 2.74725
39 4ZGS NAD 0.03586 0.42424 2.74725
40 2WSB NAD 0.00001704 0.53389 2.75591
41 4D79 ATP 0.03101 0.43981 2.89855
42 4ITU NAI 0.0000181 0.55542 2.97398
43 4ITU 1HS 0.0000397 0.51351 2.97398
44 1CER NAD 0.03235 0.42222 3.02198
45 5E4R NAP 0.03525 0.41646 3.02198
46 5EPO NAP 0.002675 0.46655 3.05344
47 2CVQ NDP 0.01328 0.43651 3.0581
48 4CQM NAP 0.000005003 0.59232 3.06513
49 2ZAT NAP 0.0001079 0.53083 3.07692
50 4OHU 2TK 0.0001728 0.46306 3.11419
51 4OHU NAD 0.0001728 0.46306 3.11419
52 2A92 NAI 0.01625 0.42632 3.11526
53 4FN4 NAD 0.00004534 0.54819 3.14961
54 4D42 NAP 0.0003227 0.46276 3.19149
55 4D42 W0I 0.0003227 0.46276 3.19149
56 4XDZ NDP 0.04445 0.41745 3.207
57 1GUZ NAD 0.01577 0.43299 3.22581
58 3NUG NAD 0.00000462 0.58971 3.23887
59 5TVI MYR 0.001773 0.48251 3.26087
60 2PD4 NAD 0.0005001 0.48625 3.27273
61 2PD4 DCN 0.0005005 0.48624 3.27273
62 5CG1 NAD BBN 0.007981 0.40348 3.27869
63 3ABI NAD 0.009558 0.44098 3.2967
64 1O6Z NAD 0.01465 0.44372 3.30033
65 1GEE NAD 0.000004237 0.59564 3.44828
66 4J7U NAP 0.0002934 0.47896 3.47222
67 4J7U YTZ 0.0002934 0.47896 3.47222
68 1XKQ NDP 0.0000789 0.52709 3.57143
69 3ICS ADP 0.04254 0.44401 3.57143
70 4NBU NAI 0.000005348 0.58682 3.6
71 1YJQ NAP 0.02392 0.41691 3.63036
72 3WMX NAD 0.0000006575 0.64806 3.63128
73 5T46 MGP 0.04185 0.44707 3.63636
74 5THQ NDP 0.00000643 0.58729 3.67647
75 4YCA NDP 0.04161 0.41686 3.7415
76 1EZ4 NAD 0.009297 0.44849 3.77358
77 3OA2 NAD 0.03399 0.41722 3.77358
78 1LDN NAD 0.01746 0.42685 3.79747
79 1QG6 TCL 0.0003104 0.47576 3.83142
80 1QG6 NAD 0.0003104 0.47576 3.83142
81 2AE2 NAP 0.00004099 0.51838 3.84615
82 2AE2 PTO 0.00004099 0.51838 3.84615
83 3CH6 311 0.0001076 0.46106 3.84615
84 3CH6 NAP 0.0001076 0.46106 3.84615
85 1E5Q NDP 0.01259 0.43759 3.84615
86 4GKV NAD 0.04009 0.40519 3.84615
87 5ITV NAI 0.00001621 0.56492 3.92157
88 4FC7 NAP 0.00002563 0.52107 3.97112
89 4FC7 COA 0.00002563 0.52107 3.97112
90 4K26 NDP 0.00001034 0.5738 3.98551
91 4K26 SFF 0.00004929 0.5179 3.98551
92 2BD0 NAP 0.00001214 0.56682 4.09836
93 1IY8 NAD 0.00001066 0.5732 4.11985
94 4DPL NAP 0.01597 0.43065 4.17827
95 4NBW NAD 0.000004017 0.6056 4.28016
96 3OJF NDP 0.0001949 0.50393 4.28016
97 3OJF IMJ 0.0001053 0.49915 4.28016
98 1WMA AB3 0.000201 0.48319 4.34783
99 1WMA NDP 0.000201 0.48319 4.34783
100 5MSO NAP 0.00000001961 0.72137 4.3956
101 1NFQ NAI 0.00000217 0.60038 4.3956
102 2GZ3 NAP 0.01624 0.42259 4.3956
103 3A06 NDP 0.03038 0.41056 4.3956
104 3A06 FOM 0.04074 0.40179 4.3956
105 3A4V NAD 0.0000001513 0.63388 4.4164
106 3A4V PYR 0.0000001513 0.63388 4.4164
107 1WP4 NDP 0.02725 0.42377 4.49827
108 3VPH NAD 0.01388 0.42748 4.51613
109 3VPH OXM 0.01992 0.41694 4.51613
110 1LUA NAP 0.008211 0.46473 4.52962
111 4OSP NAP 0.000009922 0.58273 4.56274
112 5JE8 NAD 0.0434 0.41797 4.63576
113 1VL8 NAP 0.000007104 0.57342 4.67033
114 5GT9 NAP 0.0001973 0.51556 4.67033
115 4EUE NAI 0.003041 0.45912 4.67033
116 1DJN ADP 0.04811 0.41991 4.67033
117 5JAQ NAI 0.01482 0.41576 4.67033
118 1GZ6 NAI 0.000182 0.51715 4.70219
119 4O0L NDP 0.00001648 0.5646 4.72727
120 1H5Q NAP 0.00001664 0.5644 4.90566
121 4U7W NDP 0.00000001159 0.72594 4.94506
122 2FR1 NDP 0.000003447 0.59136 4.94506
123 1U1I NAD 0.04971 0.40101 4.94506
124 3OID NDP 0.00003172 0.54463 5.03876
125 1ZBQ NAD 0.0001309 0.52046 5.19878
126 4HXY NDP 0.000002977 0.59839 5.21978
127 4CLO NAP 0.00006162 0.54942 5.21978
128 3JQA NAP 0.00006367 0.54874 5.21978
129 4CME NAP 0.00007252 0.54237 5.21978
130 5JDI NAP 0.00007649 0.54128 5.21978
131 3JQB NAP 0.00009689 0.5401 5.21978
132 3JQG NAP 0.0001012 0.53921 5.21978
133 4CLR NAP 0.00008632 0.53883 5.21978
134 3JQF NAP 0.00007304 0.53865 5.21978
135 3BMQ NAP 0.0000731 0.53863 5.21978
136 5JDC NAP 0.00008977 0.53804 5.21978
137 3BMO NAP 0.00009573 0.53673 5.21978
138 5JCJ NAP 0.00009951 0.53595 5.21978
139 4CM8 NAP 0.0001001 0.53582 5.21978
140 4CM4 NAP 0.0001084 0.5342 5.21978
141 5K6A NAP 0.0000957 0.53324 5.21978
142 4CMI NAP 0.0001185 0.53239 5.21978
143 4CM9 NAP 0.0001032 0.53174 5.21978
144 3JQ7 NAP 0.000175 0.52793 5.21978
145 3JQ8 NAP 0.0001349 0.52636 5.21978
146 3JQ9 NAP 0.0001456 0.52484 5.21978
147 3BMN NAP 0.0001488 0.52441 5.21978
148 2WD7 NAP 0.00009703 0.53646 5.22388
149 1VM6 NAD 0.01753 0.43745 5.26316
150 1EBF NAD 0.04702 0.41829 5.30726
151 4YAG NAI 0.000344 0.47622 5.53633
152 3H4V NAP 0.0002621 0.48323 5.55556
153 3H4V DVP 0.0002682 0.48052 5.55556
154 3AY6 NAI 0.0000302 0.53262 5.57621
155 3AY6 BGC 0.0004525 0.45735 5.57621
156 1YXM ADE 0.0001762 0.5905 5.61056
157 2WYV NAD 0.0001734 0.52134 5.74713
158 3A28 NAD 0.000004872 0.59285 5.81395
159 4PVD NDP 0.000009918 0.59142 5.84795
160 1AE1 NAP 0.00008913 0.52475 5.86081
161 5L4L NAP 0.00003125 0.57607 5.92105
162 5L4L 7OX 0.0005613 0.47912 5.92105
163 2DC1 NAD 0.04537 0.41309 5.9322
164 4XB2 NDP 0.007097 0.46214 5.97015
165 4XB2 HSE 0.02511 0.41775 5.97015
166 2CFC NAD 0.000005965 0.59306 6.04396
167 1ZEM NAD 0.000002508 0.62012 6.10687
168 1YS4 NAP 0.03109 0.432 6.21469
169 3VZS NAP 0.000006658 0.53847 6.22568
170 3VZS CAA 0.0003354 0.43991 6.22568
171 1GEG NAD 0.0000198 0.56478 6.25
172 2Q2V NAD 0.00004451 0.53811 6.27451
173 3QWI NAP 0.00007032 0.53257 6.2963
174 3QWI CUE 0.0002779 0.4822 6.2963
175 1Z6Z NAP 0.0001096 0.53053 6.38298
176 1F06 NDP 0.03235 0.41451 6.5625
177 2V6G NAP 0.0001803 0.51734 6.59341
178 2DKN NAI 0.00002109 0.56744 6.66667
179 1U7T NAD 0.000004167 0.60485 6.89655
180 1U7T TDT 0.000008036 0.5441 6.89655
181 5N2I NAP 0.02942 0.43573 6.89655
182 1Y1P NMN AMP PO4 0.00001663 0.59439 7.01754
183 1JAY NAP 0.03297 0.43068 7.07547
184 3EB9 FLC 0.0393 0.44603 7.14286
185 2JAP NDP 0.00001812 0.56272 7.28745
186 2JAH NDP 0.00003116 0.55201 7.28745
187 2YY7 NAD 0.0000008975 0.62208 7.37179
188 4JBI NDP 0.04462 0.41737 7.41758
189 4ZA2 NAD 0.00001506 0.57426 7.50988
190 3H8V ATP 0.02657 0.44347 7.53425
191 1N5D NDP 0.00001862 0.56219 7.63889
192 4UEC MGT 0.03392 0.45919 7.69231
193 1PR9 NAP 0.00001656 0.55714 7.78689
194 3D3W NAP 0.00002909 0.54629 7.78689
195 3C1O NAP 0.009188 0.4538 7.78816
196 1PZG A3D 0.02129 0.41236 7.85498
197 3RJ5 NAD 0.00001125 0.54747 7.87402
198 2B4Q NAP 0.0001578 0.52323 7.97101
199 4TQG NDP 0.0000003098 0.65308 8.04954
200 5L4S 6KX 0.00003503 0.52991 8.1761
201 5L4S NAP 0.00003503 0.52991 8.1761
202 4QED NAP 0.00001324 0.57284 8.46774
203 1Q7B NAP 0.000007852 0.58329 9.01639
204 4NBT NAD 0.000006397 0.59164 9.16667
205 1FK8 NAD 0.00002443 0.5769 9.33852
206 5CAE COA 0.031 0.42742 9.34066
207 4R1S NAP 0.00000008287 0.69129 9.49555
208 2X6T NAP 0.0000003671 0.6446 9.52381
209 2X6T ADP BMA 0.02855 0.43903 9.52381
210 5F5N NAD 0.00005691 0.55495 9.68858
211 3QV1 NAD 0.03144 0.42493 9.7561
212 1LSS NAD 0.01318 0.45401 10
213 1O5I NAD 0.001532 0.50633 10.0402
214 4Q9N NAI 0.0003152 0.50631 10.0671
215 2C29 NAP 0.000006153 0.54272 10.3858
216 2C29 DQH 0.000016 0.5264 10.3858
217 1KYQ NAD 0.02867 0.44454 10.5839
218 5OCA 9QZ 0.01343 0.49308 11.1111
219 3ORF NAD 0.0003323 0.51147 11.1554
220 1W6U NAP 0.000006313 0.61045 11.2583
221 1W6U HXC 0.03271 0.43086 11.2583
222 2AG5 NAD 0.0001103 0.5304 11.3821
223 1W73 NAP 0.000007544 0.60662 11.5894
224 1W8D NAP 0.000008698 0.60356 11.5894
225 1TI7 NAP 0.03256 0.43341 12.5
226 1TE2 PGA 0.04853 0.44914 12.8319
227 5T2U NAP 0.00001386 0.56056 12.9032
228 1XG5 NAP 0.00007745 0.53403 12.9121
229 3SJU NDP 0.000003289 0.59642 13.9785
230 1VL0 NAI 0.000001184 0.64102 14.0411
231 3AFN NAP 0.00006699 0.53024 15.1163
232 5L95 AMP 0.0235 0.44355 16.25
233 1EQ2 NAP 0.000001883 0.61188 17.4194
234 1EQ2 ADQ 0.01583 0.44985 17.4194
235 2EXX NAP 0.001074 0.47434 18.3007
236 2Q46 NAP 0.000008968 0.58478 20.1581
237 1HDO NAP 0.000001316 0.60173 20.3883
238 2C5A NAD 0.000002703 0.53133 20.8791
239 2C5A GDC 0.000002703 0.53133 20.8791
240 2VUT NAD 0.03958 0.42893 20.9302
241 1MXH DHF 0.0001079 0.50657 23.913
242 1MXH NAP 0.0002085 0.49465 23.913
243 2GUE NAG 0.03924 0.40682 24.5902
244 1GY8 NAD 0.000001494 0.61201 28.5714
245 1GY8 UDP 0.006318 0.4966 28.5714
246 2Q1W NAD 0.000003449 0.58732 28.8462
247 2PZM UDP 0.000002191 0.56036 35.1515
248 2PZM NAD 0.000002191 0.56036 35.1515
249 3LU1 NAD 0.00000005891 0.68123 35.4396
250 3LU1 UD2 0.0001738 0.54318 35.4396
251 1KEW TYD 0.000000001217 0.66261 39.0582
252 1KEW NAD 0.000000002167 0.64948 39.0582
253 4GLL NAD 0.0000001627 0.65087 40.3561
254 1RKX NAD 0.00000006385 0.67428 40.8964
255 1EK6 NAI 0.00000003754 0.59767 41.092
256 1EK6 UPG 0.000001296 0.53744 41.092
257 1BXK NAD 0.0000001285 0.67094 41.6901
258 1OC2 NAD 0.000000002414 0.63299 41.954
259 1OC2 TDX 0.000000002414 0.63299 41.954
260 1ORR NAD 0.00000008641 0.65826 44.0922
261 1ORR CDP 0.04508 0.44585 44.0922
262 4ZRN NAD 0.00000007362 0.65651 46.4744
263 4ZRN UPG 0.0000002979 0.57772 46.4744
Pocket No.: 2; Query (leader) PDB : 5IN4; Ligand: 6CK; 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: 5in4.bio1) has 135 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5IN4; Ligand: 6CK; 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: 5in4.bio1) has 134 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 5IN4; Ligand: GDP; Similar sites found: 268
This union binding pocket(no: 4) in the query (biounit: 5in4.bio1) has 133 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5T9E NAP 0.01754 0.43459 1.10701
2 4D3F NAP 0.03211 0.43074 1.29032
3 3CIF NAD 0.04226 0.41218 1.39276
4 5T9F TYR 0.01008 0.42558 1.47601
5 5T9F NAP 0.01325 0.42228 1.47601
6 1E3W NAD 0.00000315 0.60069 1.53257
7 1E6W NAD 0.000002785 0.60315 1.53846
8 3WXB NDP 0.000004591 0.58897 1.79211
9 4MDH NAD 0.003809 0.46389 1.79641
10 5MDH NAD 0.001992 0.47723 1.8018
11 4PIV NDP 0.00001717 0.56296 1.92308
12 3I6I NDP 0.001272 0.46126 2.02312
13 1LLU NAD 0.04719 0.4015 2.04678
14 4XDY NAI 0.04799 0.41329 2.07101
15 3V1Y NAD 0.03496 0.42003 2.07715
16 2HJR APR 0.002296 0.48618 2.13415
17 4XFR CIT 0.04638 0.44262 2.1978
18 4O1M NAD 0.0002243 0.51546 2.22222
19 3O26 NDP 0.000004686 0.59276 2.2508
20 1XSE NDP 0.000009309 0.54373 2.37288
21 5L53 NAP 0.000009366 0.61123 2.46914
22 4OOE NDP 0.02117 0.43063 2.47253
23 4R5M NAP 0.02421 0.42365 2.47253
24 3OJO NAD 0.0452 0.42078 2.47253
25 4R5M 4NO 0.04169 0.40888 2.47253
26 3GGO ENO 0.0239 0.40364 2.54777
27 3GGO NAI 0.0239 0.40364 2.54777
28 5KKA 6V0 0.01947 0.42221 2.5641
29 5BXV MGP 0.03403 0.45169 2.60417
30 1NVM NAD 0.04411 0.40774 2.6087
31 3MJE NDP 0.00000887 0.58001 2.62097
32 1EJ4 M7G 0.01419 0.46993 2.63158
33 1EJH M7G 0.03102 0.44402 2.63158
34 3B20 NAD 0.03391 0.42493 2.65487
35 5DOZ NDP 0.04006 0.4063 2.66272
36 5U5G NAP 0.04181 0.4124 2.71186
37 5HV7 RBL 0.006931 0.4768 2.74725
38 1MUU NAD 0.0203 0.43376 2.74725
39 1MV8 NAD 0.02457 0.42749 2.74725
40 4ZGS NAD 0.03411 0.42479 2.74725
41 2WSB NAD 0.00001907 0.53108 2.75591
42 2F1K NAP 0.04875 0.41493 2.86738
43 4D79 ATP 0.03123 0.4391 2.89855
44 4ITU NAI 0.00002168 0.55114 2.97398
45 4ITU 1HS 0.00004407 0.51092 2.97398
46 1CER NAD 0.03281 0.42138 3.02198
47 5E4R NAP 0.03318 0.41717 3.02198
48 5EPO NAP 0.00292 0.46416 3.05344
49 2CVQ NDP 0.01261 0.43699 3.0581
50 4CQM NAP 0.000005604 0.58918 3.06513
51 2ZAT NAP 0.000113 0.52916 3.07692
52 4OHU 2TK 0.0001901 0.46087 3.11419
53 4OHU NAD 0.0001901 0.46087 3.11419
54 2A92 NAI 0.01457 0.42789 3.11526
55 4FN4 NAD 0.00005112 0.54501 3.14961
56 4D42 W0I 0.0003472 0.46088 3.19149
57 4D42 NAP 0.0003472 0.46088 3.19149
58 4XDZ NDP 0.04033 0.41902 3.207
59 1GUZ NAD 0.01521 0.43317 3.22581
60 3NUG NAD 0.000005412 0.58572 3.23887
61 2PD4 NAD 0.0004796 0.48634 3.27273
62 2PD4 DCN 0.0004817 0.48626 3.27273
63 5CG1 NAD BBN 0.005625 0.40816 3.27869
64 3ABI NAD 0.009636 0.44024 3.2967
65 1O6Z NAD 0.01505 0.44256 3.30033
66 1GEE NAD 0.000004876 0.59196 3.44828
67 4J7U NAP 0.0003512 0.47515 3.47222
68 4J7U YTZ 0.0003512 0.47515 3.47222
69 1XKQ NDP 0.00008793 0.52425 3.57143
70 3ICS ADP 0.04269 0.44339 3.57143
71 4NBU NAI 0.00000617 0.58314 3.6
72 1YJQ NAP 0.02101 0.41888 3.63036
73 3WMX NAD 0.0000006211 0.6483 3.63128
74 5THQ NDP 0.000007574 0.58316 3.67647
75 4YCA NDP 0.03995 0.4172 3.7415
76 1EZ4 NAD 0.009068 0.44842 3.77358
77 3OA2 NAD 0.03408 0.41662 3.77358
78 1LDN NAD 0.01661 0.42727 3.79747
79 1QG6 NAD 0.0003239 0.47433 3.83142
80 1QG6 TCL 0.0003239 0.47433 3.83142
81 2AE2 PTO 0.00004809 0.51477 3.84615
82 2AE2 NAP 0.00004809 0.51477 3.84615
83 3CH6 NAP 0.0001129 0.45961 3.84615
84 3CH6 311 0.0001129 0.45961 3.84615
85 1E5Q NDP 0.01121 0.43938 3.84615
86 4GKV NAD 0.03622 0.40662 3.84615
87 5ITV NAI 0.00001675 0.56345 3.92157
88 4FC7 NAP 0.00002718 0.51925 3.97112
89 4FC7 COA 0.00002718 0.51925 3.97112
90 4K26 NDP 0.00001106 0.57164 3.98551
91 4K26 SFF 0.00005194 0.51618 3.98551
92 2BD0 NAP 0.00001553 0.56119 4.09836
93 1IY8 NAD 0.00001221 0.56968 4.11985
94 4DPL NAP 0.0145 0.43202 4.17827
95 5LD5 NAD 0.03903 0.42405 4.18994
96 4NBW NAD 0.00000481 0.60103 4.28016
97 3OJF NDP 0.0001988 0.50283 4.28016
98 3OJF IMJ 0.0001147 0.49691 4.28016
99 1WMA NDP 0.000217 0.48115 4.34783
100 1WMA AB3 0.000217 0.48115 4.34783
101 5ABU GTG 0.0496 0.44868 4.34783
102 5MSO NAP 0.00000001972 0.72018 4.3956
103 1NFQ NAI 0.000002583 0.59608 4.3956
104 2GZ3 NAP 0.0168 0.42138 4.3956
105 3A06 NDP 0.02741 0.41199 4.3956
106 3A06 FOM 0.03827 0.40243 4.3956
107 3A4V PYR 0.0000001442 0.63376 4.4164
108 3A4V NAD 0.0000001442 0.63376 4.4164
109 1WP4 NDP 0.02506 0.42498 4.49827
110 2CVZ NDP 0.04872 0.41297 4.49827
111 3VPH NAD 0.01345 0.42752 4.51613
112 3VPH OXM 0.01801 0.41828 4.51613
113 1LUA NAP 0.008216 0.46412 4.52962
114 4OSP NAP 0.00001115 0.57952 4.56274
115 5JE8 NAD 0.0418 0.41825 4.63576
116 1VL8 NAP 0.000007734 0.57093 4.67033
117 5GT9 NAP 0.0002177 0.51289 4.67033
118 4EUE NAI 0.003089 0.45818 4.67033
119 1DJN ADP 0.04842 0.41925 4.67033
120 5JAQ NAI 0.01382 0.41644 4.67033
121 1GZ6 NAI 0.0001921 0.51535 4.70219
122 4O0L NDP 0.00001812 0.5619 4.72727
123 1H5Q NAP 0.00001863 0.56135 4.90566
124 1I36 NAP 0.03869 0.42654 4.92424
125 4U7W NDP 0.00000001078 0.72634 4.94506
126 2FR1 NDP 0.000003636 0.58943 4.94506
127 1U1I NAD 0.04705 0.40156 4.94506
128 3OID NDP 0.00003584 0.54149 5.03876
129 1ZBQ NAD 0.0001457 0.51763 5.19878
130 4HXY NDP 0.000003023 0.5972 5.21978
131 4CLO NAP 0.00006741 0.5468 5.21978
132 3JQA NAP 0.0000717 0.54553 5.21978
133 4CME NAP 0.00007976 0.53967 5.21978
134 5JDI NAP 0.0000855 0.53826 5.21978
135 3JQB NAP 0.0001074 0.53722 5.21978
136 4CLR NAP 0.00009505 0.53612 5.21978
137 3JQF NAP 0.00008043 0.53595 5.21978
138 3BMQ NAP 0.00008092 0.53583 5.21978
139 3JQG NAP 0.0001155 0.53574 5.21978
140 5JDC NAP 0.0001008 0.53493 5.21978
141 3BMO NAP 0.0001049 0.53413 5.21978
142 4CM8 NAP 0.0001113 0.53292 5.21978
143 5JCJ NAP 0.0001114 0.53291 5.21978
144 4CM4 NAP 0.0001185 0.53165 5.21978
145 4CMI NAP 0.0001253 0.53052 5.21978
146 5K6A NAP 0.0001085 0.52998 5.21978
147 4CM9 NAP 0.0001137 0.52904 5.21978
148 3JQ7 NAP 0.0001942 0.52506 5.21978
149 3JQ8 NAP 0.0001506 0.52342 5.21978
150 3JQ9 NAP 0.0001586 0.52239 5.21978
151 3BMN NAP 0.000165 0.5216 5.21978
152 2WD7 NAP 0.0001101 0.53315 5.22388
153 1VM6 NAD 0.01799 0.43634 5.26316
154 1EBF NAD 0.04312 0.41967 5.30726
155 4YAG NAI 0.0003346 0.47599 5.53633
156 3H4V NAP 0.0002892 0.48079 5.55556
157 3H4V DVP 0.0002784 0.47915 5.55556
158 3AY6 NAI 0.00003123 0.53121 5.57621
159 3AY6 BGC 0.0005128 0.45465 5.57621
160 1YXM ADE 0.0001433 0.59944 5.61056
161 2WYV NAD 0.0001657 0.52151 5.74713
162 3A28 NAD 0.000005263 0.59043 5.81395
163 4PVD NDP 0.00001116 0.58811 5.84795
164 1AE1 NAP 0.0001061 0.52063 5.86081
165 5L4L NAP 0.00003294 0.57414 5.92105
166 5L4L 7OX 0.0005594 0.47849 5.92105
167 2DC1 NAD 0.04377 0.41332 5.9322
168 4XB2 NDP 0.005864 0.46571 5.97015
169 4XB2 HSE 0.0213 0.42043 5.97015
170 2CFC NAD 0.000007102 0.58866 6.04396
171 3S5W FAD 0.04902 0.40733 6.04396
172 1ZEM NAD 0.000002844 0.6166 6.10687
173 1YS4 NAP 0.03398 0.42946 6.21469
174 3VZS NAP 0.00000668 0.53756 6.22568
175 3VZS CAA 0.0003443 0.43884 6.22568
176 1GEG NAD 0.00002195 0.5619 6.25
177 2Q2V NAD 0.00004582 0.53677 6.27451
178 3QWI NAP 0.00008085 0.52909 6.2963
179 3QWI CUE 0.000312 0.47947 6.2963
180 1Z6Z NAP 0.0001225 0.52754 6.38298
181 1F06 NDP 0.03396 0.413 6.5625
182 2V6G NAP 0.0001817 0.51645 6.59341
183 2DKN NAI 0.00002297 0.56489 6.66667
184 1U7T NAD 0.000004878 0.60074 6.89655
185 1U7T TDT 0.000008732 0.5418 6.89655
186 5N2I NAP 0.02861 0.43583 6.89655
187 1Y1P NMN AMP PO4 0.00001601 0.59439 7.01754
188 1JAY NAP 0.03248 0.43047 7.07547
189 3EB9 FLC 0.03969 0.44525 7.14286
190 2JAP NDP 0.00001914 0.56082 7.28745
191 2JAH NDP 0.00003709 0.54778 7.28745
192 2YY7 NAD 0.000000879 0.62155 7.37179
193 4JBI NDP 0.04316 0.41756 7.41758
194 4ZA2 NAD 0.0000167 0.57134 7.50988
195 3H8V ATP 0.02615 0.4433 7.53425
196 1N5D NDP 0.00001922 0.56074 7.63889
197 4UEC MGT 0.02546 0.46576 7.69231
198 1PR9 NAP 0.0000192 0.55347 7.78689
199 3D3W NAP 0.00003245 0.54339 7.78689
200 3C1O NAP 0.008941 0.4538 7.78816
201 1PZG A3D 0.02104 0.41203 7.85498
202 3RJ5 NAD 0.00001191 0.5456 7.87402
203 2B4Q NAP 0.0001767 0.52022 7.97101
204 4TQG NDP 0.0000003092 0.65215 8.04954
205 5L4S NAP 0.00003822 0.52752 8.1761
206 5L4S 6KX 0.00003822 0.52752 8.1761
207 4QED NAP 0.00001588 0.56837 8.46774
208 1Q7B NAP 0.000008846 0.58006 9.01639
209 4NBT NAD 0.000007448 0.5877 9.16667
210 1FK8 NAD 0.00002758 0.57353 9.33852
211 5CAE COA 0.02922 0.42817 9.34066
212 4R1S NAP 0.00000008727 0.68919 9.49555
213 2X6T NAP 0.0000003609 0.64398 9.52381
214 2X6T ADP BMA 0.02789 0.43903 9.52381
215 5F5N NAD 0.00005958 0.55322 9.68858
216 3QV1 NAD 0.03062 0.42495 9.7561
217 2DT5 NAD 0.04994 0.40872 9.95261
218 1LSS NAD 0.01231 0.45498 10
219 1O5I NAD 0.001621 0.50438 10.0402
220 4Q9N NAI 0.0003338 0.50446 10.0671
221 2C29 NAP 0.000004893 0.54577 10.3858
222 2C29 DQH 0.00001313 0.52894 10.3858
223 1KYQ NAD 0.02938 0.4434 10.5839
224 3ORF NAD 0.0003802 0.50803 11.1554
225 1W6U NAP 0.000006611 0.6086 11.2583
226 2AG5 NAD 0.0001324 0.526 11.3821
227 1W73 NAP 0.000007643 0.60549 11.5894
228 1W8D NAP 0.000008781 0.60251 11.5894
229 1TI7 NAP 0.0318 0.43341 12.5
230 5T2U NAP 0.00001507 0.55812 12.9032
231 1XG5 NAP 0.0001017 0.52789 12.9121
232 3SJU NDP 0.000003856 0.59241 13.9785
233 1VL0 NAI 0.00000123 0.63927 14.0411
234 3AFN NAP 0.00006784 0.52923 15.1163
235 2WMC MGP 0.02551 0.45203 15.7303
236 5L95 AMP 0.01763 0.44964 16.25
237 2VT3 ATP 0.04479 0.44216 16.7442
238 1EQ2 NAP 0.000001856 0.61126 17.4194
239 1EQ2 ADQ 0.01544 0.44985 17.4194
240 2EXX NAP 0.001082 0.47353 18.3007
241 2Q46 NAP 0.000009956 0.58182 20.1581
242 1HDO NAP 0.00000115 0.60337 20.3883
243 2C5A NAD 0.000002006 0.53505 20.8791
244 2C5A GDC 0.000002006 0.53505 20.8791
245 2VUT NAD 0.03867 0.42893 20.9302
246 1MXH DHF 0.0001182 0.50417 23.913
247 1MXH NAP 0.0002186 0.49306 23.913
248 2GUE NAG 0.03861 0.40682 24.5902
249 1GY8 NAD 0.000001408 0.61227 28.5714
250 1GY8 UDP 0.006202 0.49647 28.5714
251 2Q1W NAD 0.000003503 0.58614 28.8462
252 2PZM NAD 0.000001612 0.56468 35.1515
253 2PZM UDP 0.000001612 0.56468 35.1515
254 3LU1 NAD 0.00000006934 0.67694 35.4396
255 3LU1 UD2 0.000168 0.54318 35.4396
256 1KEW TYD 0.000000001151 0.66231 39.0582
257 1KEW NAD 0.000000002055 0.64916 39.0582
258 4GLL NAD 0.0000001514 0.65128 40.3561
259 1RKX NAD 0.00000006469 0.67299 40.8964
260 1EK6 NAI 0.00000003284 0.59869 41.092
261 1EK6 UPG 0.0000009914 0.54058 41.092
262 1BXK NAD 0.0000001151 0.67217 41.6901
263 1OC2 TDX 0.000000002423 0.63178 41.954
264 1OC2 NAD 0.000000002423 0.63178 41.954
265 1ORR NAD 0.00000009212 0.65601 44.0922
266 1ORR CDP 0.04417 0.44585 44.0922
267 4ZRN NAD 0.00000007037 0.65634 46.4744
268 4ZRN UPG 0.000000247 0.57977 46.4744
Pocket No.: 5; Query (leader) PDB : 5IN4; 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: 5in4.bio1) has 133 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 5IN4; 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: 5in4.bio1) has 133 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 5IN4; Ligand: 6CK; 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: 5in4.bio1) has 133 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 5IN4; Ligand: GDP; 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: 5in4.bio1) has 133 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 5IN4; Ligand: GDP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 5in4.bio1) has 133 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 5IN4; Ligand: NAP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 5in4.bio1) has 135 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 11; Query (leader) PDB : 5IN4; Ligand: GDP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 11) in the query (biounit: 5in4.bio1) has 131 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 12; Query (leader) PDB : 5IN4; Ligand: NAP; Similar sites found: 265
This union binding pocket(no: 12) in the query (biounit: 5in4.bio1) has 136 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5T9E NAP 0.01825 0.43459 1.10701
2 4D3F NAP 0.03328 0.43074 1.29032
3 3CIF NAD 0.0439 0.41218 1.39276
4 5T9F TYR 0.01057 0.42558 1.47601
5 5T9F NAP 0.01388 0.42228 1.47601
6 1E3W NAD 0.000002802 0.60436 1.53257
7 1E6W NAD 0.000002379 0.60764 1.53846
8 3WXB NDP 0.000004323 0.59146 1.79211
9 4MDH NAD 0.003984 0.46389 1.79641
10 5MDH NAD 0.002044 0.47766 1.8018
11 4PIV NDP 0.00001759 0.56372 1.92308
12 3I6I NDP 0.001313 0.46168 2.02312
13 1LLU NAD 0.04913 0.4015 2.04678
14 4XDY NAI 0.04978 0.41329 2.07101
15 3V1Y NAD 0.03631 0.42003 2.07715
16 2HJR APR 0.002414 0.48604 2.13415
17 4XFR CIT 0.04764 0.44262 2.1978
18 4O1M NAD 0.0002122 0.51766 2.22222
19 3O26 NDP 0.000004394 0.59535 2.2508
20 1XSE NDP 0.000008631 0.54633 2.37288
21 5L53 NAP 0.000008475 0.61471 2.46914
22 4OOE NDP 0.0219 0.43074 2.47253
23 4R5M NAP 0.0247 0.42407 2.47253
24 3OJO NAD 0.04682 0.42078 2.47253
25 4R5M 4NO 0.04251 0.40928 2.47253
26 3GGO ENO 0.026 0.40298 2.54777
27 3GGO NAI 0.026 0.40298 2.54777
28 5KKA 6V0 0.0194 0.42311 2.5641
29 1NVM NAD 0.04587 0.40774 2.6087
30 3MJE NDP 0.000008088 0.58312 2.62097
31 1EJ4 M7G 0.01459 0.46993 2.63158
32 1EJH M7G 0.03501 0.44203 2.63158
33 3B20 NAD 0.03518 0.42493 2.65487
34 5DOZ NDP 0.04016 0.40704 2.66272
35 5U5G NAP 0.04663 0.41093 2.71186
36 5HV7 RBL 0.007124 0.4768 2.74725
37 1MUU NAD 0.02098 0.43388 2.74725
38 1MV8 NAD 0.02555 0.42749 2.74725
39 4ZGS NAD 0.03328 0.42614 2.74725
40 2WSB NAD 0.00001743 0.53389 2.75591
41 4D79 ATP 0.03078 0.44026 2.89855
42 4ITU NAI 0.00001849 0.55542 2.97398
43 4ITU 1HS 0.00004061 0.51351 2.97398
44 1CER NAD 0.03239 0.42246 3.02198
45 5E4R NAP 0.0345 0.41717 3.02198
46 5EPO NAP 0.00306 0.46416 3.05344
47 2CVQ NDP 0.01315 0.43699 3.0581
48 4CQM NAP 0.000005112 0.59232 3.06513
49 2ZAT NAP 0.00011 0.53083 3.07692
50 4OHU NAD 0.0001787 0.46292 3.11419
51 4OHU 2TK 0.0001787 0.46292 3.11419
52 2A92 NAI 0.01522 0.42789 3.11526
53 4FN4 NAD 0.00004623 0.54819 3.14961
54 4D42 W0I 0.0003299 0.46276 3.19149
55 4D42 NAP 0.0003299 0.46276 3.19149
56 4XDZ NDP 0.04218 0.41885 3.207
57 1GUZ NAD 0.01585 0.43317 3.22581
58 3NUG NAD 0.000004782 0.58946 3.23887
59 2PD4 DCN 0.0004932 0.48686 3.27273
60 2PD4 NAD 0.0004943 0.48681 3.27273
61 5CG1 NAD BBN 0.005972 0.40816 3.27869
62 3ABI NAD 0.01006 0.44024 3.2967
63 1O6Z NAD 0.01484 0.44372 3.30033
64 1GEE NAD 0.00000433 0.59564 3.44828
65 4J7U YTZ 0.0003283 0.47738 3.47222
66 4J7U NAP 0.0003283 0.47738 3.47222
67 1XKQ NDP 0.00007107 0.52949 3.57143
68 3ICS ADP 0.04298 0.44401 3.57143
69 4NBU NAI 0.000005465 0.58682 3.6
70 1YJQ NAP 0.02192 0.41888 3.63036
71 3WMX NAD 0.0000006647 0.6483 3.63128
72 5THQ NDP 0.000006568 0.58729 3.67647
73 4YCA NDP 0.04147 0.4172 3.7415
74 1EZ4 NAD 0.009457 0.44842 3.77358
75 3OA2 NAD 0.03443 0.41722 3.77358
76 1LDN NAD 0.01733 0.42727 3.79747
77 1QG6 TCL 0.0003169 0.47576 3.83142
78 1QG6 NAD 0.0003169 0.47576 3.83142
79 2AE2 PTO 0.00004191 0.51838 3.84615
80 2AE2 NAP 0.00004191 0.51838 3.84615
81 3CH6 311 0.0001104 0.46106 3.84615
82 3CH6 NAP 0.0001104 0.46106 3.84615
83 1E5Q NDP 0.0117 0.43938 3.84615
84 4GKV NAD 0.03775 0.40662 3.84615
85 5ITV NAI 0.00001655 0.56492 3.92157
86 4FC7 NAP 0.00002623 0.52107 3.97112
87 4FC7 COA 0.00002623 0.52107 3.97112
88 4K26 NDP 0.00001056 0.5738 3.98551
89 4K26 SFF 0.00004954 0.51819 3.98551
90 2BD0 NAP 0.0000124 0.56682 4.09836
91 1IY8 NAD 0.00001088 0.5732 4.11985
92 4DPL NAP 0.01513 0.43202 4.17827
93 5LD5 NAD 0.04045 0.42405 4.18994
94 4NBW NAD 0.000004103 0.6056 4.28016
95 3OJF NDP 0.0001987 0.50393 4.28016
96 3OJF IMJ 0.0001062 0.49938 4.28016
97 1WMA AB3 0.0002052 0.48319 4.34783
98 1WMA NDP 0.0002052 0.48319 4.34783
99 5MSO NAP 0.00000002012 0.72137 4.3956
100 1NFQ NAI 0.00000222 0.60038 4.3956
101 2GZ3 NAP 0.01648 0.42259 4.3956
102 3A06 NDP 0.0286 0.41199 4.3956
103 3A06 FOM 0.03992 0.40243 4.3956
104 3A4V PYR 0.0000001553 0.63388 4.4164
105 3A4V NAD 0.0000001553 0.63388 4.4164
106 1WP4 NDP 0.02607 0.42498 4.49827
107 3VPH NAD 0.01408 0.42748 4.51613
108 3VPH OXM 0.02041 0.41676 4.51613
109 1LUA NAP 0.008543 0.46412 4.52962
110 4OSP NAP 0.00001013 0.58273 4.56274
111 5JE8 NAD 0.04336 0.41825 4.63576
112 1VL8 NAP 0.000007261 0.57342 4.67033
113 5GT9 NAP 0.0002009 0.51556 4.67033
114 4EUE NAI 0.00309 0.45912 4.67033
115 1DJN ADP 0.0445 0.42192 4.67033
116 5JAQ NAI 0.01449 0.41644 4.67033
117 1GZ6 NAI 0.0001854 0.51715 4.70219
118 4O0L NDP 0.00001682 0.5646 4.72727
119 1H5Q NAP 0.00001699 0.5644 4.90566
120 1I36 NAP 0.04008 0.42654 4.92424
121 4U7W NDP 0.00000001168 0.72634 4.94506
122 2FR1 NDP 0.000003525 0.59136 4.94506
123 1U1I NAD 0.04839 0.4018 4.94506
124 3OID NDP 0.00003468 0.5433 5.03876
125 1ZBQ NAD 0.0001334 0.52046 5.19878
126 4HXY NDP 0.000003044 0.59839 5.21978
127 4CLO NAP 0.00006278 0.54942 5.21978
128 3JQA NAP 0.00006487 0.54874 5.21978
129 4CME NAP 0.00007389 0.54237 5.21978
130 5JDI NAP 0.00007794 0.54128 5.21978
131 3JQB NAP 0.00009867 0.5401 5.21978
132 3JQG NAP 0.0001031 0.53921 5.21978
133 4CLR NAP 0.00008794 0.53883 5.21978
134 3JQF NAP 0.00007444 0.53865 5.21978
135 3BMQ NAP 0.0000745 0.53863 5.21978
136 5JDC NAP 0.00009145 0.53804 5.21978
137 3BMO NAP 0.00009752 0.53673 5.21978
138 5JCJ NAP 0.0001014 0.53595 5.21978
139 4CM8 NAP 0.000102 0.53582 5.21978
140 4CM4 NAP 0.0001104 0.5342 5.21978
141 5K6A NAP 0.00009751 0.53324 5.21978
142 4CMI NAP 0.0001207 0.53239 5.21978
143 4CM9 NAP 0.0001051 0.53174 5.21978
144 3JQ7 NAP 0.0001781 0.52793 5.21978
145 3JQ8 NAP 0.0001374 0.52636 5.21978
146 3JQ9 NAP 0.0001483 0.52484 5.21978
147 3BMN NAP 0.0001515 0.52441 5.21978
148 2WD7 NAP 0.00009884 0.53646 5.22388
149 1VM6 NAD 0.01776 0.43745 5.26316
150 1EBF NAD 0.0447 0.41967 5.30726
151 4YAG NAI 0.0003511 0.47622 5.53633
152 3H4V NAP 0.0002675 0.48323 5.55556
153 3H4V DVP 0.0002738 0.48052 5.55556
154 3AY6 NAI 0.00003086 0.53262 5.57621
155 3AY6 BGC 0.0004624 0.45735 5.57621
156 1YXM ADE 0.0001488 0.59944 5.61056
157 2WYV NAD 0.0001751 0.52151 5.74713
158 3A28 NAD 0.000004978 0.59285 5.81395
159 4PVD NDP 0.00001012 0.59142 5.84795
160 1AE1 NAP 0.00009089 0.52475 5.86081
161 5L4L NAP 0.00003183 0.57607 5.92105
162 5L4L 7OX 0.0005718 0.47912 5.92105
163 2DC1 NAD 0.04545 0.41332 5.9322
164 4XB2 NDP 0.006112 0.46571 5.97015
165 4XB2 HSE 0.02222 0.42043 5.97015
166 2CFC NAD 0.000006091 0.59306 6.04396
167 1ZEM NAD 0.000002561 0.62012 6.10687
168 1YS4 NAP 0.03146 0.432 6.21469
169 3VZS NAP 0.000006827 0.53847 6.22568
170 3VZS CAA 0.0003712 0.43884 6.22568
171 1GEG NAD 0.0000202 0.56478 6.25
172 2Q2V NAD 0.00004542 0.53811 6.27451
173 3QWI NAP 0.00007171 0.53257 6.2963
174 3QWI CUE 0.0002847 0.48213 6.2963
175 1Z6Z NAP 0.0001116 0.53053 6.38298
176 1F06 NDP 0.03278 0.41451 6.5625
177 2V6G NAP 0.0001818 0.51754 6.59341
178 2DKN NAI 0.00002151 0.56744 6.66667
179 1U7T NAD 0.000004255 0.60485 6.89655
180 1U7T TDT 0.000008232 0.5441 6.89655
181 5N2I NAP 0.02977 0.43573 6.89655
182 1Y1P NMN AMP PO4 0.00001694 0.59439 7.01754
183 1JAY NAP 0.03336 0.43068 7.07547
184 3EB9 FLC 0.03971 0.44603 7.14286
185 2JAP NDP 0.00001849 0.56272 7.28745
186 2JAH NDP 0.00003179 0.55201 7.28745
187 2YY7 NAD 0.0000009187 0.62208 7.37179
188 4JBI NDP 0.04477 0.41756 7.41758
189 4ZA2 NAD 0.00001537 0.57426 7.50988
190 3H8V ATP 0.02759 0.44285 7.53425
191 1N5D NDP 0.00002044 0.56074 7.63889
192 4UEC MGT 0.02617 0.46576 7.69231
193 1PR9 NAP 0.00001691 0.55714 7.78689
194 3D3W NAP 0.0000297 0.54629 7.78689
195 3C1O NAP 0.009313 0.4538 7.78816
196 1PZG A3D 0.022 0.41203 7.85498
197 3RJ5 NAD 0.00001151 0.54747 7.87402
198 2B4Q NAP 0.0001607 0.52323 7.97101
199 4TQG NDP 0.0000003172 0.65308 8.04954
200 5L4S 6KX 0.00003579 0.52991 8.1761
201 5L4S NAP 0.00003579 0.52991 8.1761
202 4QED NAP 0.00001351 0.57284 8.46774
203 1Q7B NAP 0.000008019 0.58329 9.01639
204 4NBT NAD 0.000006532 0.59164 9.16667
205 1FK8 NAD 0.00002564 0.57628 9.33852
206 5CAE COA 0.03138 0.42742 9.34066
207 4R1S NAP 0.0000000849 0.69129 9.49555
208 2X6T NAP 0.000000376 0.6446 9.52381
209 2X6T ADP BMA 0.02888 0.43903 9.52381
210 5F5N NAD 0.00005797 0.55495 9.68858
211 3QV1 NAD 0.03175 0.42498 9.7561
212 2DT5 NAD 0.04855 0.41009 9.95261
213 1LSS NAD 0.01279 0.45498 10
214 1O5I NAD 0.001554 0.50633 10.0402
215 4Q9N NAI 0.0003133 0.50678 10.0671
216 2C29 NAP 0.000005176 0.5461 10.3858
217 2C29 DQH 0.00001294 0.53044 10.3858
218 1KYQ NAD 0.02899 0.44454 10.5839
219 3ORF NAD 0.0003381 0.51147 11.1554
220 1W6U NAP 0.000006439 0.61045 11.2583
221 1W6U HXC 0.0331 0.43086 11.2583
222 2AG5 NAD 0.0001123 0.5304 11.3821
223 1W73 NAP 0.000007693 0.60662 11.5894
224 1W8D NAP 0.00000887 0.60356 11.5894
225 1TI7 NAP 0.03295 0.43341 12.5
226 1TE2 PGA 0.04897 0.44914 12.8319
227 5T2U NAP 0.00001416 0.56056 12.9032
228 1XG5 NAP 0.00007895 0.53403 12.9121
229 3SJU NDP 0.000003363 0.59642 13.9785
230 1VL0 NAI 0.000001209 0.64102 14.0411
231 3AFN NAP 0.00007202 0.52923 15.1163
232 2WMC MGP 0.02618 0.45203 15.7303
233 5L95 AMP 0.01828 0.44964 16.25
234 2VT3 ATP 0.04619 0.44216 16.7442
235 1EQ2 NAP 0.000001925 0.61188 17.4194
236 1EQ2 ADQ 0.01603 0.44985 17.4194
237 2EXX NAP 0.001093 0.47434 18.3007
238 2Q46 NAP 0.000009155 0.58478 20.1581
239 1HDO NAP 0.000001236 0.60337 20.3883
240 2C5A GDC 0.000002188 0.53505 20.8791
241 2C5A NAD 0.000002188 0.53505 20.8791
242 2VUT NAD 0.04004 0.42893 20.9302
243 1MXH DHF 0.0001124 0.5062 23.913
244 1MXH NAP 0.0002127 0.49465 23.913
245 2GUE NAG 0.03955 0.40682 24.5902
246 1GY8 NAD 0.000001529 0.61201 28.5714
247 1GY8 UDP 0.006424 0.49647 28.5714
248 2Q1W NAD 0.000003466 0.58767 28.8462
249 2PZM NAD 0.000001746 0.56468 35.1515
250 2PZM UDP 0.000001746 0.56468 35.1515
251 3LU1 NAD 0.00000006043 0.68123 35.4396
252 3LU1 UD2 0.0001767 0.54318 35.4396
253 1KEW TYD 0.000000001262 0.66261 39.0582
254 1KEW NAD 0.000000002246 0.64948 39.0582
255 4GLL NAD 0.0000001634 0.65128 40.3561
256 1RKX NAD 0.00000006552 0.67428 40.8964
257 1EK6 NAI 0.00000003882 0.59767 41.092
258 1EK6 UPG 0.000001086 0.54058 41.092
259 1BXK NAD 0.000000124 0.67217 41.6901
260 1OC2 NAD 0.000000002506 0.63299 41.954
261 1OC2 TDX 0.000000002506 0.63299 41.954
262 1ORR NAD 0.0000000887 0.65826 44.0922
263 1ORR CDP 0.04553 0.44585 44.0922
264 4ZRN NAD 0.00000007561 0.65651 46.4744
265 4ZRN UPG 0.0000002704 0.57977 46.4744
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