Receptor
PDB id Resolution Class Description Source Keywords
5UQW 1.5 Å EC: 3.6.5.- CRYSTAL STRUCTURE OF HUMAN KRAS G12V MUTANT IN COMPLEX WITH HOMO SAPIENS KRAS GTPASE HYDROLASE
Ref.: MULTIVALENT SMALL-MOLECULE PAN-RAS INHIBITORS. CELL V. 168 878 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GDP A:1002;
B:1002;
Valid;
Valid;
none;
none;
submit data
443.201 C10 H15 N5 O11 P2 c1nc2...
MG B:1001;
A:1001;
Part of Protein;
Part of Protein;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5UQW 1.5 Å EC: 3.6.5.- CRYSTAL STRUCTURE OF HUMAN KRAS G12V MUTANT IN COMPLEX WITH HOMO SAPIENS KRAS GTPASE HYDROLASE
Ref.: MULTIVALENT SMALL-MOLECULE PAN-RAS INHIBITORS. CELL V. 168 878 2017
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 8 families.
1 5US4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
2 5UQW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
3 5USJ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
70% Homology Family (147)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 14 families.
1 3RS3 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
2 2CL6 - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
3 5WDO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
4 3TGP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
5 1P2T - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
6 4Q01 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
7 4M21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
8 821P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
9 1Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
10 6Q21 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
11 4L9W - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
12 4WA7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
13 3V4F - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
14 3K9N - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
15 4M1T - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
16 4XVQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
17 5V71 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
18 2QUZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
19 1CLU Kd = 5.4 nM DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
20 4L8G - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
21 2RGD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
22 4PZY - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
23 4LPK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
24 4DLV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
25 4LRW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
26 2CLD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
27 4M1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
28 3L8Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
29 3LBH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
30 721P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
31 1LF5 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
32 1GNR - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
33 4LUC - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
34 2RGE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
35 4DLS - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
36 4M22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
37 4DLY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
38 1ZW6 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
39 2RGC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
40 5V9L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
41 2CL0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
42 4TQA - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
43 3RRZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
44 2EVW - XY2 C12 H15 N5 O4 CC(=O)N(C)....
45 2RGB - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
46 4LDJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
47 1XJ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
48 1ZVQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
49 1P2S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
50 5V6V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
51 621P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
52 1P2V - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
53 2CL7 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
54 3OIW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
55 4LV6 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
56 4DLT - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
57 1P2U - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
58 5V6S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
59 3RS0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
60 5B30 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
61 5B2Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
62 3KKN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
63 4M1O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
64 4M1Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
65 3I3S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
66 4OBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
67 3RRY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
68 1QRA - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
69 4LYJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
70 121P - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
71 1RVD - DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
72 2RGA - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
73 3RS7 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
74 5UHV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
75 2CLC - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
76 4EPT - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
77 4EPY Kd = 340 uM 0QY C21 H21 N5 O c1ccc2c(c1....
78 4DLZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
79 1AGP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
80 1GNQ - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
81 2Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
82 3RS2 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
83 4L9S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
84 4M1S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
85 4EPV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
86 5WDP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
87 4TQ9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
88 3K8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
89 3OIV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
90 4Q02 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
91 3LBI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
92 3RSL - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
93 1LF0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
94 1XCM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
95 421P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
96 4DLR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
97 2CE2 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
98 4QL3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
99 4Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
100 4DLU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
101 1CTQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
102 3OIU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
103 3RS5 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
104 4EPW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
105 5WDQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
106 1IOZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
107 221P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
108 4LYH - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
109 4DLX - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
110 4Q03 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
111 4PZZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
112 3KKM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
113 1JAI - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
114 3L8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
115 3RS4 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
116 3LBN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
117 4NMM - Y9Z C14 H22 N6 O12 P2 CC(=O)NCCO....
118 3RSO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
119 4XVR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
120 5P21 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
121 5F2E - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
122 4EPX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
123 4EPR - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
124 4DLW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
125 5V9O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
126 2RGG - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
127 4LYF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
128 1JAH - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
129 5US4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
130 5UQW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
131 5USJ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
132 4DSU - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
133 4DST - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
134 4DSO - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
135 4DSN - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
136 1KAO - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
137 3RAP - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
138 1X1S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
139 3X1Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
140 3X1Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
141 3X1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
142 3X1X - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
143 1U8Z - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
144 1U90 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
145 1U8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
146 5WDR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
147 5WDS - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
50% Homology Family (246)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 141 families.
1 1Z2A - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
2 1Z22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
3 1YZT - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
4 1YZU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
5 1Z08 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
6 1Z0I - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
7 4DKX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
8 2Y8E - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
9 2A5J - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
10 4LHW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
11 4LHV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
12 2P2L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
13 2W2V - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
14 1MH1 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
15 2WKP - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
16 2WKQ - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
17 3RS3 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
18 2CL6 - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
19 5WDO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
20 3TGP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
21 1P2T - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
22 4Q01 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
23 4M21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
24 821P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
25 1Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
26 6Q21 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
27 4L9W - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
28 4WA7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
29 3V4F - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
30 3K9N - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
31 4M1T - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
32 4XVQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
33 5V71 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
34 2QUZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
35 1CLU Kd = 5.4 nM DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
36 4L8G - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
37 2RGD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
38 4PZY - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
39 4LPK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
40 4DLV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
41 4LRW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
42 2CLD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
43 4M1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
44 3L8Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
45 3LBH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
46 721P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
47 1LF5 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
48 1GNR - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
49 4LUC - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
50 2RGE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
51 4DLS - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
52 4M22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
53 4DLY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
54 1ZW6 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
55 2RGC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
56 5V9L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
57 2CL0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
58 4TQA - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
59 3RRZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
60 2EVW - XY2 C12 H15 N5 O4 CC(=O)N(C)....
61 2RGB - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
62 4LDJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
63 1XJ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
64 1ZVQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
65 1P2S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
66 5V6V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
67 621P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
68 1P2V - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
69 2CL7 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
70 3OIW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
71 4LV6 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
72 4DLT - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
73 1P2U - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
74 5V6S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
75 3RS0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
76 5B30 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
77 5B2Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
78 3KKN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
79 4M1O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
80 4M1Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
81 3I3S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
82 4OBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
83 3RRY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
84 1QRA - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
85 4LYJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
86 121P - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
87 1RVD - DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
88 2RGA - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
89 3RS7 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
90 5UHV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
91 2CLC - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
92 4EPT - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
93 4EPY Kd = 340 uM 0QY C21 H21 N5 O c1ccc2c(c1....
94 4DLZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
95 1AGP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
96 1GNQ - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
97 2Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
98 3RS2 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
99 4L9S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
100 4M1S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
101 4EPV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
102 5WDP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
103 4TQ9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
104 3K8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
105 3OIV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
106 4Q02 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
107 3LBI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
108 3RSL - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
109 1LF0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
110 1XCM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
111 421P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
112 4DLR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
113 2CE2 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
114 4QL3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
115 4Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
116 4DLU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
117 1CTQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
118 3OIU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
119 3RS5 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
120 4EPW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
121 5WDQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
122 1IOZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
123 221P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
124 4LYH - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
125 4DLX - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
126 4Q03 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
127 4PZZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
128 3KKM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
129 1JAI - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
130 3L8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
131 3RS4 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
132 3LBN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
133 4NMM - Y9Z C14 H22 N6 O12 P2 CC(=O)NCCO....
134 3RSO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
135 4XVR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
136 5P21 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
137 5F2E - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
138 4EPX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
139 4EPR - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
140 4DLW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
141 5V9O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
142 2RGG - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
143 4LYF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
144 1JAH - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
145 1YU9 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
146 2BME - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
147 2BMD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
148 1YZN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
149 3RWM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
150 3RWO - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
151 3REG - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
152 2F9L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
153 2F9M - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
154 1YZK - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
155 1OIV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
156 2FE4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
157 2FFQ - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
158 2E9S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
159 5US4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
160 5UQW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
161 5USJ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
162 3NKV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
163 1HUQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
164 1Z07 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
165 1N6R - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
166 1Z0D - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
167 1N6H - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
168 1N6P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
169 1N6K - GDP AF3 n/a n/a
170 1N6N - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
171 1N6I - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
172 1R2Q - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
173 1N6L - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
174 1N6O - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
175 1TU4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
176 1EK0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
177 1S8F - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
178 1YZL - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
179 1WMS - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
180 1D5C - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
181 1Z0F - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
182 3E5H - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
183 4DSU - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
184 4DST - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
185 4DSO - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
186 4DSN - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
187 1KAO - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
188 3RAP - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
189 1YZQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
190 2GIL - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
191 1Z0A - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
192 1KY2 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
193 1KY3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
194 2HT6 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
195 3KKO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
196 3KKQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
197 3KKP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
198 1X1R - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
199 1X1S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
200 1T91 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
201 1VG8 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
202 2GCP - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
203 2GCN - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
204 2J0V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
205 3X1Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
206 3X1Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
207 3X1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
208 3X1X - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
209 4Z8Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
210 1G17 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
211 1G16 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
212 1M7B - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
213 2DPX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
214 3Q7Q - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
215 3Q7P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
216 3Q72 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
217 1U8Z - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
218 1U90 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
219 1U8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
220 1YVD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
221 5WDR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
222 5WDS - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
223 1Z06 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
224 3TH5 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
225 3SBD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
226 1OIX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
227 1OIW - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
228 2QRZ - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
229 1A4R Kd = 9.4 pM GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
230 1KMQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
231 1DPF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
232 1FTN - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
233 1A2B - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
234 4U5X - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
235 3Q85 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
236 1RYH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
237 1RYF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
238 1VG1 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
239 3RAB - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
240 1GWN - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
241 2EW1 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
242 4O25 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
243 4O2R - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
244 4O2L - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
245 1XTQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
246 3SEA - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
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
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5UQW; Ligand: GDP; Similar sites found: 407
This union binding pocket(no: 1) in the query (biounit: 5uqw.bio2) has 27 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4LPS GDP 0.0000001674 0.64399 None
2 2QZ4 ADP 0.00006 0.51504 None
3 1KO8 6PG 0.0004206 0.46084 None
4 3KC1 2T6 0.009528 0.40124 1.5873
5 1HTW ADP 0.00003221 0.43359 2.1164
6 4RLQ 3SK 0.0272 0.40505 2.1164
7 2WJH GDP 0.00000005046 0.53302 2.40964
8 2WJH FLC 0.000007489 0.46748 2.40964
9 5I0H ADP BEF 0.00001985 0.47739 2.6455
10 5VGR GDP 0.000289 0.47275 2.6455
11 2Q2Y ADP 0.001032 0.44854 2.6455
12 2Q2Y MKR 0.001026 0.4475 2.6455
13 2GDJ ANP 0.0002066 0.40225 2.6455
14 4YMJ 4EJ 0.03535 0.40006 2.6455
15 4D81 ADP 0.0001665 0.48873 3.1746
16 2FSH ANP 0.001236 0.46896 3.1746
17 3H86 AP5 0.000652 0.45083 3.1746
18 4RZ3 ADP 0.00007878 0.44489 3.1746
19 2QEN ADP 0.0001261 0.43459 3.1746
20 5HR5 ADP 0.0001429 0.43089 3.1746
21 4TTQ ATP 0.000201 0.40712 3.1746
22 3BOS CDP 0.00009991 0.51719 3.30579
23 2HCJ GDP 0.00000000006207 0.83703 3.7037
24 3U6B GDP 0.00000000006745 0.83521 3.7037
25 5JBQ GDP 0.0000000002391 0.79361 3.7037
26 3U6K GDP 0.0000000004704 0.77916 3.7037
27 2BVN GNP 0.0000000002718 0.75409 3.7037
28 4PC3 GDP 0.00000001194 0.67877 3.7037
29 1D8T GDP 0.0000000001633 0.58747 3.7037
30 4G5G GDP 0.0000000002716 0.58147 3.7037
31 2ZFI ADP 0.00001502 0.55765 3.7037
32 2DPY ADP 0.00003855 0.5528 3.7037
33 3B9Q MLI 0.00006832 0.54641 3.7037
34 5L3W GDP 0.000005403 0.47282 3.7037
35 3ZQ6 ADP ALF 0.00006537 0.46212 3.7037
36 4KBF AMP 0.002548 0.4531 3.7037
37 2J5V PCA 0.00549 0.44569 3.7037
38 1P72 ADP 0.001083 0.43879 3.7037
39 4E03 ADP 0.00004569 0.43641 3.7037
40 1IN4 ADP 0.0002547 0.42918 3.7037
41 2Y65 ADP 0.000002485 0.41611 3.7037
42 2W58 ADP 0.0000006277 0.4113 3.7037
43 5M7P ADP 0.0009437 0.41049 3.7037
44 1VHT BA3 0.0006276 0.40444 3.7037
45 2Z48 NGA 0.04701 0.40266 3.7037
46 2R75 01G 0.003484 0.41335 3.84615
47 1TQ4 GDP 0.00000002619 0.63738 4.11622
48 1GOJ ADP 0.0000001655 0.70089 4.2328
49 1F9V ADP 0.000002107 0.62642 4.2328
50 5L3V GDP 0.000002804 0.57743 4.2328
51 5I34 GDP 0.00003617 0.53192 4.2328
52 5L3S GNP 0.00003205 0.48973 4.2328
53 5XDR ADP 0.0004732 0.47831 4.2328
54 1Z6T ADP 0.0002374 0.47658 4.2328
55 5H56 TYD 0.001688 0.42788 4.2328
56 5H56 ADP 0.001688 0.42788 4.2328
57 3BFV ADP 0.00003096 0.54221 4.42804
58 1ZN7 HSX 0.02379 0.40005 4.44444
59 1ZN7 ADE 0.02379 0.40005 4.44444
60 4JLV ADP 0.000416 0.49281 4.46097
61 1IWE IMP 0.0009277 0.4878 4.59519
62 3WY9 GDP 0.00000000009905 0.82679 4.7619
63 1D2E GDP 0.00000001022 0.68186 4.7619
64 1YRB GDP 0.0000000001244 0.63229 4.7619
65 1YQT ADP 0.00001405 0.58348 4.7619
66 3WYA GDP 0.0000000005289 0.57667 4.7619
67 5GVR LMR 0.000146 0.52979 4.7619
68 3Q9L ATP 0.00009001 0.49548 4.7619
69 4LJ9 ACP 0.0006285 0.4779 4.7619
70 2FAH GDP 0.0003517 0.47384 4.7619
71 1YTM ATP 0.0004701 0.45437 4.7619
72 1NJF AGS 0.0002616 0.4419 4.7619
73 1NJF ADP 0.0001259 0.44108 4.7619
74 4OHY ANP 0.0007518 0.43417 4.7619
75 3P4X ADP 0.00002766 0.42016 4.7619
76 2KIN ADP 0.00000074 0.41467 4.7619
77 4FCW ADP 0.0002956 0.40727 4.7619
78 1T5C ADP 0.000001882 0.40596 4.7619
79 3EZ2 ADP 0.00007876 0.52926 4.77387
80 3IIJ ADP 0.000007214 0.57332 5
81 4MKF AP5 0.003086 0.42909 5.06912
82 1NU4 MLA 0.007929 0.44993 5.15464
83 3FYH ADP 0.002449 0.41336 5.2795
84 4RD0 GDP 0.0000000008919 0.65351 5.29101
85 2PZE ATP 0.000004951 0.61511 5.29101
86 4WZ6 ATP 0.00002517 0.56935 5.29101
87 1SQ5 ADP 0.00005398 0.52357 5.29101
88 5LB3 ADP 0.0001068 0.52258 5.29101
89 2OBM ADP 0.0002473 0.51981 5.29101
90 5GJC ATP 0.00009656 0.51791 5.29101
91 5J1J ANP 0.0001096 0.47239 5.29101
92 3ZS9 ADP ALF 0.00008224 0.45869 5.29101
93 2WOJ ADP ALF 0.00009307 0.45672 5.29101
94 2B8W ALF 5GP 0.0003992 0.44532 5.29101
95 3QKT ANP 0.0009606 0.42985 5.29101
96 4P32 ADP 0.002296 0.42117 5.29101
97 3VM7 GLC 0.0216 0.41787 5.29101
98 1F2U ATP 0.001553 0.40931 5.29101
99 3CV2 OXL 0.01772 0.40217 5.29101
100 4ADC PLP 0.01834 0.40188 5.29101
101 3DKP ADP 0.0002417 0.40024 5.29101
102 2XT3 ADP 0.0000005209 0.66669 5.82011
103 3H4S ADP 0.0000007594 0.65783 5.82011
104 2ZPA ADP 0.0001353 0.48248 5.82011
105 3FWY ADP 0.00001071 0.47349 5.82011
106 3IO3 ADP 0.0000258 0.44892 5.82011
107 3COB ADP 0.0000004463 0.43409 5.82011
108 4FRZ ADP 0.000002614 0.42645 5.82011
109 3RC3 ANP 0.008653 0.42625 5.82011
110 3E70 GDP 0.000002998 0.58384 6.34921
111 3ZFD ANP 0.000009119 0.55342 6.34921
112 1GOT GDP 0.000000802 0.54187 6.34921
113 3CNL GNP 0.000000003275 0.53772 6.34921
114 1G3Q ADP 0.0000587 0.52182 6.34921
115 1R6B ADP 0.00009125 0.51263 6.34921
116 5BQ5 ADP BEF 0.00007399 0.51077 6.34921
117 2PL3 ADP 0.0001995 0.5089 6.34921
118 1ION ADP 0.0001261 0.49991 6.34921
119 5N69 ADP 0.000322 0.4756 6.34921
120 2FNA ADP 0.0001716 0.46868 6.34921
121 2XAU ADP 0.0005936 0.46836 6.34921
122 1FP6 ADP 0.0000371 0.44605 6.34921
123 4PFO ADP 0.0005767 0.44066 6.34921
124 4IOK ADP 0.01085 0.41853 6.34921
125 4IOK XPO 0.009065 0.4176 6.34921
126 1LVG ADP 0.000001137 0.63199 6.87831
127 4AG5 ADP 0.000005661 0.60373 6.87831
128 2XTN GTP 0.00000151 0.53689 6.87831
129 2HF9 GSP 0.000002236 0.52736 6.87831
130 3TBK ANP 0.0003734 0.50175 6.87831
131 4ZNL BEF ADP 0.0002185 0.49442 6.87831
132 4XTR ADP 0.0001021 0.48784 6.87831
133 3T34 GDP 0.00006736 0.48113 6.87831
134 2JLR ANP 0.0005031 0.46671 6.87831
135 4XTR ATP 0.000229 0.45916 6.87831
136 4XVU ATP 0.0002377 0.45849 6.87831
137 4PJ3 ANP 0.003107 0.43043 6.87831
138 4GBM A3P 0.001442 0.42612 6.87831
139 1UKZ ADP 0.004242 0.41515 6.87831
140 1OXV ANP 0.00004163 0.40701 6.87831
141 2WHX ADP 0.0000243 0.40043 6.87831
142 4WOP CTP 0.0003526 0.45975 7.11111
143 4P3Y GDP 0.00000000007283 0.58373 7.14286
144 1BO4 COA 0.01205 0.4147 7.14286
145 3FVQ ATP 0.0002584 0.46555 7.24234
146 2VB6 ADP BEF 0.0004527 0.44693 7.38255
147 1G7C 5GP 0.0000003288 0.63928 7.40741
148 4ZKD GDP 0.00000001439 0.60094 7.40741
149 4CVN ADP 0.000006291 0.59355 7.40741
150 1JI0 ATP 0.00001334 0.57665 7.40741
151 5IRR GSP 0.000001425 0.55639 7.40741
152 1KK1 GNP 0.000000002174 0.55 7.40741
153 4V03 ADP 0.00002721 0.53115 7.40741
154 4QOS ADP 0.0003833 0.47727 7.40741
155 4GOX A3P 0.0006607 0.43155 7.40741
156 3BFX A3P 0.002477 0.427 7.40741
157 3DC4 ADP 0.000008894 0.41828 7.40741
158 4WEI GLC GAL 0.0256 0.40221 7.40741
159 5LTJ ADP 0.0001691 0.40886 7.42297
160 4H1V GNP 0.000005535 0.54982 7.85908
161 3EC1 GDP 0.000000002153 0.73475 7.93651
162 3LRE ADP 0.0000001397 0.70522 7.93651
163 2VVG ADP 0.000000181 0.69756 7.93651
164 4ZG4 VO4 ADP 0.00004851 0.48703 7.93651
165 1IHU AF3 0.00007845 0.48301 7.93651
166 1IHU ADP 0.0001126 0.47191 7.93651
167 4R2I ANP 0.001716 0.46746 7.93651
168 1L2T ATP 0.001267 0.42498 7.93651
169 1OYY AGS 0.007985 0.42353 7.93651
170 1P9B GDP 0.006711 0.41446 7.93651
171 5WRJ A3P 0.003489 0.40712 7.93651
172 2WJG GDP 0.00000001139 0.7111 7.97872
173 5MVR ADP 0.00003922 0.42307 8.02469
174 1JJV ATP 0.00002477 0.56796 8.46561
175 5MZN ADP 0.0009224 0.48141 8.46561
176 2OFW ADX 0.0008216 0.45164 8.46561
177 3UIE ANP 0.00005676 0.43141 8.46561
178 1X6V ADP 0.001011 0.4052 8.46561
179 2GWH A3P 0.01044 0.40277 8.46561
180 1R0X ATP 0.0002213 0.40161 8.46561
181 5H67 ATP 0.004174 0.43288 8.54271
182 3KTA AP5 0.000233 0.48204 8.67052
183 4KFU ACP 0.00001055 0.414 8.96226
184 1B7T ADP 0.000265 0.48479 8.97436
185 3VMF GTP 0.000000006957 0.6252 8.99471
186 1AZT GSP 0.00000007875 0.55684 8.99471
187 3EWA ANP 0.000065 0.52637 8.99471
188 5IRN ADP 0.00008395 0.50237 8.99471
189 1FNN ADP 0.000204 0.47464 8.99471
190 4A4Z ANP 0.005025 0.43346 8.99471
191 5IFS ADP 0.0001599 0.41707 8.99471
192 1BG2 ADP 0.0000007983 0.41463 8.99471
193 1NST A3P 0.006774 0.41123 8.99471
194 2WIC GNP 0.000000261 0.63473 9.52381
195 4YDS ATP 0.00002238 0.56502 9.52381
196 3TK1 GDP 0.000000000149 0.56106 9.52381
197 2BEK ATP 0.0008048 0.44038 9.52381
198 1W5T ANP 0.0009443 0.41555 9.70874
199 5GOE GDP 0.000000008792 0.69486 10.0529
200 2IYL GDP 0.000002166 0.59901 10.0529
201 1SKQ GDP 0.000000005428 0.53948 10.0529
202 1KK8 BEF ADP 0.0001424 0.48655 10.0719
203 2ODE ALF GDP 0.0000001532 0.547 10.2857
204 1QHH ATP 0.01733 0.40307 10.4348
205 1SVK ALF GDP 0.0000001131 0.54288 10.4816
206 2C78 GNP 0.000000002924 0.66971 10.582
207 2C77 GNP 0.000000004276 0.61842 10.582
208 4NON GDP 0.0000003927 0.53582 10.582
209 1F5N GNP 0.00023 0.44137 10.582
210 3ISO GSH 0.0358 0.40064 10.582
211 4J0Q GDP 0.0000000003151 0.80145 11.1111
212 3WXM GTP 0.000000008888 0.63686 11.1111
213 3NHB ADP 0.00000966 0.59172 11.1111
214 4PX9 ADP 0.00007725 0.52968 11.1111
215 5FTB ANP 0.0001666 0.49424 11.1111
216 3DZD ADP 0.0007147 0.45972 11.1111
217 5FHD ADP ALF 0.0004794 0.45401 11.1111
218 5G41 AP5 0.006081 0.42018 11.1111
219 5WRI A3P 0.00249 0.41968 11.1111
220 2OM2 GDP 0.0000006358 0.57779 11.3846
221 4R98 GNH 0.0000006075 0.62617 11.4391
222 1JJ7 ADP 0.000001373 0.65455 11.6402
223 2XTZ GSP 0.00000002186 0.60678 11.6402
224 4R43 GDP 0.0001244 0.51251 11.6402
225 4XGU ADP 0.0003889 0.46697 11.6402
226 4OKD GLC GLC GLC 0.007562 0.43231 11.6402
227 2IXE ATP 0.0005532 0.42891 11.6402
228 1ZIN AP5 0.003202 0.42733 11.6402
229 3B5J 12D 0.00003577 0.55448 12.1693
230 4YMU ATP 0.00003965 0.54429 12.1693
231 1XX6 ADP 0.0002078 0.52138 12.1693
232 2C04 GCP 0.00008569 0.49644 12.1693
233 2VF7 ADP 0.0004073 0.48144 12.1693
234 1Y63 ADP 0.000009506 0.44043 12.1693
235 5TSH ANP 0.00002794 0.42418 12.1693
236 5TSH ADP 0.00001906 0.40691 12.1693
237 1Y3A GDP 0.000001113 0.55479 12.462
238 1GP2 GDP 0.000001002 0.55667 12.6761
239 3PQC GDP 0.00000001532 0.68355 12.6984
240 4BAS GNP 0.00000004992 0.5874 12.6984
241 1V8K ANP 0.000006908 0.57424 12.6984
242 4QM7 GTP 0.00006025 0.52799 12.6984
243 5L3R GCP 0.000008686 0.51272 12.6984
244 1P4V GLY 0.02952 0.40483 12.6984
245 1BH2 GSP 0.0000002485 0.53995 13.0159
246 1JWY GDP 0.000002214 0.49571 13.2275
247 1JWY ADP 0.0001396 0.41121 13.2275
248 1FQJ GDP 0.0000004697 0.57027 13.2308
249 1FQK GDP 0.000001042 0.55596 13.2308
250 1FQJ ALF 0.0003862 0.50495 13.2308
251 1FQK ALF 0.001495 0.47551 13.2308
252 4NCN GTP 0.0000000003807 0.69805 13.7566
253 4TMZ GSP 0.0000000008196 0.68428 13.7566
254 3CX8 GSP 0.00000005187 0.61323 13.7566
255 3AB3 GDP 0.0000001533 0.56169 13.7566
256 1ZCB GDP 0.0000008808 0.55548 13.7566
257 1XKV ATP 0.0001734 0.49343 13.7566
258 3ZIA ADP 0.0001364 0.42762 13.7566
259 3ZIA ATP 0.00007262 0.42207 13.7566
260 4UOX PLP 0.01952 0.40056 13.7566
261 2CBZ ATP 0.000000698 0.66815 13.9241
262 1MKY GDP 0.00000000008187 0.8165 14.2857
263 4LYA ATP 0.00003699 0.53145 14.2857
264 3RLF ANP 0.0004855 0.43634 14.2857
265 2AWN ADP 0.0000001541 0.40951 14.2857
266 1TAD ALF 0.0000001428 0.54755 14.5062
267 1TAD GDP 0.0000001428 0.54755 14.5062
268 4HI0 GDP 0.0000003831 0.58725 14.8148
269 1M7G ADX 0.0007614 0.44377 14.8148
270 1M7G ADP 0.0009823 0.43614 14.8148
271 1M7G AV2 0.000009165 0.43302 14.8148
272 1CS4 GSP 0.0000000632 0.56953 15.3439
273 5X40 ACP 0.001022 0.42349 15.3439
274 1UPT GTP 0.0000000004224 0.70513 15.7895
275 3QF7 ANP 0.0009679 0.44494 15.873
276 4HSE ADP 0.00002797 0.53728 16.4021
277 1NY5 ADP 0.0007356 0.45455 16.4021
278 2X77 GDP 0.0000000002067 0.78361 16.9312
279 4LC1 GDP 0.000000001131 0.76042 16.9312
280 4BQS ADP 0.00004886 0.53246 16.9312
281 4IEE AGS 0.0005112 0.4883 16.9312
282 5EE5 GTP 0.00000000007161 0.69651 16.9591
283 5CK5 GDP 0.0000000001803 0.57723 17.4603
284 3A4M ADP 0.000005054 0.42841 17.4603
285 2IS6 ADP 0.00007618 0.40954 17.4603
286 3N5C GDP 0.000000002356 0.74475 17.9012
287 3PCR GTP 0.0000000163 0.63061 17.9012
288 3W5J GDP 0.000001394 0.63449 17.9894
289 3BER AMP 0.006743 0.42716 17.9894
290 1PUJ GNP 0.00000002861 0.66137 18.5185
291 1H65 GDP 0.00001126 0.51855 19.0476
292 2CHG ANP 0.0001659 0.43093 19.0476
293 1D2N ANP 0.00423 0.41329 19.0476
294 2RCN GDP 0.00000000004025 0.83167 19.5767
295 5K5Z ANP 0.0001806 0.45929 19.5767
296 3DEF GDP 0.000001202 0.5019 20.1058
297 4PPF FLC 0.000005631 0.61586 21.6931
298 2ZR9 DTP 0.0001555 0.4009 21.6931
299 2FH5 GTP 0.00000000005309 0.75323 22.2222
300 1W0J ADP 0.0001304 0.4936 22.2222
301 1W0J ADP BEF 0.0005188 0.45684 22.2222
302 2CK3 ANP 0.0005758 0.45485 22.2222
303 3VX3 ADP 0.0001019 0.44622 22.2222
304 2CK3 ADP 0.0006835 0.43953 22.2222
305 2V7Q ATP 0.00007574 0.429 22.2222
306 2V7Q ADP 0.00007711 0.41486 22.2222
307 5FG3 GDP 0.00000000003663 0.59312 22.7513
308 1HFE CYS 0.03064 0.40037 22.7642
309 1G7S GDP 0.000000001418 0.74345 23.8095
310 3KJI ADP 0.005162 0.41731 24.3386
311 5J1S ATP 0.001967 0.41722 24.3386
312 4B47 GDP 0.00000000003042 0.85265 24.8677
313 3T1O GDP 0.0000002102 0.63021 24.8677
314 3T12 GDP ALF 0.0000002355 0.58936 24.8677
315 4YS0 ADP 0.001268 0.44393 24.8677
316 4M9Q GNP 0.0000000007635 0.6943 25.3968
317 2W83 GTP 0.000000002847 0.66193 25.3968
318 1NRJ GTP 0.0000000235 0.6394 25.3968
319 2A5F GTP 0.000000002692 0.65499 25.9259
320 1WF3 GNP 0.00000002111 0.59433 26.455
321 4V0K GDP 0.0000006268 0.55901 26.6272
322 3DOE GTP 0.000000001721 0.67096 26.9841
323 1KSH GDP 0.0000000006198 0.64885 26.9841
324 1OS1 ATP 0.001648 0.42683 26.9841
325 1OS1 PYR 0.001788 0.42683 26.9841
326 4KAX GTP 0.000000001946 0.67716 27.2189
327 1J2J GTP 0.0000000008242 0.68418 28.5714
328 2J59 GTP 0.000000001779 0.67037 28.5714
329 1O3Y GTP 0.000000002372 0.6482 28.5714
330 1MR3 G3D 0.000000001038 0.58039 28.5714
331 1SVI GDP 0.0000000001882 0.81274 29.1005
332 1S9D GDP 0.000000004149 0.72108 29.1005
333 1RE0 GDP 0.0000000004087 0.56601 29.1005
334 4YLG GDP 0.000000002926 0.69682 29.6296
335 3AQ4 GDP 0.000000003275 0.56534 29.6296
336 1DAR GDP 0.00000001838 0.70087 30.1587
337 1ZJ6 G3D 0.000000003233 0.72628 30.4813
338 1YZG GDP 0.000000003234 0.72627 31.2849
339 2QN6 GDP 0.0000000001887 0.81268 33.3333
340 1R4A GNP 0.0000000004536 0.68634 33.3333
341 3A1S GDP 0.0000001382 0.64798 34.3915
342 1F6B GDP 0.00000002629 0.54212 34.9206
343 2ZEJ GDP 0.000000627 0.53828 35.3261
344 1WDT GTP 0.000000583 0.58637 35.4497
345 1FZQ GDP 0.0000000002847 0.78989 36.5079
346 4ZI2 GNP 0.0000000003501 0.70857 36.5079
347 4GOJ GNP 0.0000000004144 0.70549 37.037
348 5DI3 GNP 0.000000001123 0.68723 37.037
349 1M2O GNP 0.00000001912 0.60861 37.037
350 5KDO GDP 0.00000061 0.57856 37.8378
351 2GJ8 ALF GDP 0.000000006356 0.61394 38.6243
352 4DCT GDP 0.0000000001582 0.78919 39.1534
353 1ZD9 GDP 0.0000000001872 0.73979 39.8936
354 3M1I GTP 0.00000000002805 0.7047 41.7989
355 3WYF GTP 0.00000000004014 0.68532 41.7989
356 3WYG GTP 0.0000000001702 0.66326 41.7989
357 3GJ7 GDP 0.00000000005801 0.82386 42.8571
358 3GJ8 GDP 0.0000000001441 0.79113 42.8571
359 3GJ5 GDP 0.0000000001528 0.7899 42.8571
360 3GJ4 GDP 0.00000000005148 0.60387 42.8571
361 3GJ0 GDP 0.00000000004573 0.82894 43.3862
362 3GJ3 GDP 0.00000000006146 0.82263 43.3862
363 3GJX GTP 0.00000000005006 0.73185 43.3862
364 4HAT GNP 0.00000000001792 0.75339 43.9153
365 1IBR GNP 0.00000000002187 0.70864 43.9153
366 1NF3 GNP 0.000000002059 0.64637 43.9153
367 1WA5 GTP 0.00000000007182 0.63981 43.9153
368 5BXQ GDP 0.0000000001165 0.60643 43.9153
369 3REF GDP 0.0000000007144 0.69551 44.4444
370 2NGR GDP 0.0000000008448 0.75426 44.9735
371 1E96 GTP 0.0000000001681 0.70711 44.9735
372 4YC7 GNP 0.0000000001926 0.68039 44.9735
373 4ITR GDP 0.000000005879 0.67405 44.9735
374 1GRN GDP 0.0000000008722 0.61996 44.9735
375 4DID GDP 0.0000000005967 0.58842 44.9735
376 2NGR AF3 0.0001517 0.52201 44.9735
377 1HE1 GDP 0.000000017 0.64546 45.5026
378 1HE1 AF3 0.001951 0.46457 45.5026
379 1I4D GDP 0.000000000032 0.85154 46.0317
380 2FJU GSP 0.0000000004354 0.71392 46.0317
381 4XOI GTP 0.0000000003607 0.69038 46.0317
382 4XSH GSP 0.0000000002746 0.73248 46.5608
383 2W2X GSP 0.0000000002445 0.7247 46.5608
384 5JCP GDP ALF 0.000000002139 0.70292 46.5608
385 1TX4 ALF GDP 0.000000001135 0.67844 46.5608
386 1CXZ GSP 0.0000000004471 0.66695 46.5608
387 1DS6 GDP 0.00000000002494 0.61288 46.5608
388 4D0N GDP 0.0000000003735 0.57895 46.5608
389 5IRC GDP 0.0000000344 0.54419 46.5608
390 4D0G GTP 0.000000000008546 0.73119 47.0899
391 1G4U GDP 0.00000002123 0.64955 47.0899
392 5HPY GDP 0.000000011 0.58206 47.0899
393 1G4U AF3 0.008494 0.43415 47.0899
394 1Z0K GTP 0.000000000008619 0.76605 47.093
395 2D7C GTP 0.00000000003305 0.73592 47.9042
396 3BC1 GNP 0.00000000001287 0.75261 48.1481
397 2HV8 GTP 0.00000000004563 0.71142 48.1481
398 3CPJ GDP 0.0000000000363 0.65415 48.1481
399 4LX0 BEF GDP 0.000000000006807 0.76737 48.6772
400 5JCZ GDP 0.0000000003479 0.72797 48.6772
401 4C4P GNP 0.00000000003405 0.70148 48.6772
402 3LXR GDP 0.0000000005636 0.75081 49.1892
403 1VG9 GDP 0.000000000003359 0.8695 49.2063
404 1VG0 GDP 0.000000000006197 0.82939 49.2063
405 2G77 GDP 0.00000000009234 0.76415 49.7355
406 1OW3 GDP 0.000000004375 0.59654 49.7355
407 2G77 AF3 0.0000404 0.55789 49.7355
Pocket No.: 2; Query (leader) PDB : 5UQW; Ligand: GDP; Similar sites found: 12
This union binding pocket(no: 2) in the query (biounit: 5uqw.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5H4I 7HQ 0.008463 0.42873 2.24719
2 2VMG MBG 0.01949 0.4188 2.54777
3 4OWK NGA 0.02058 0.41391 3.7037
4 4ZM4 PLP 0.02258 0.40264 4.2328
5 3CQL NAG 0.02377 0.40841 4.7619
6 1QF5 GDP 0.02375 0.42061 6.34921
7 1QF5 RPL 0.02375 0.42061 6.34921
8 4LH7 NMN 0.0202 0.41392 7.93651
9 2JG1 ANP 0.01017 0.40153 10.0529
10 1YXM ADE 0.03766 0.40778 12.1693
11 1LNX URI 0.02534 0.40932 12.3457
12 4FFG 0U8 0.02639 0.40718 14.8148
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