Receptor
PDB id Resolution Class Description Source Keywords
4L9W 1.95 Å EC: 3.6.5.2 CRYSTAL STRUCTURE OF H-RAS G12C, GMPPNP-BOUND HOMO SAPIENS GTPASE ACTIVATING MUTANT SIGNALING PROTEIN
Ref.: K-RAS(G12C) INHIBITORS ALLOSTERICALLY CONTROL GTP A AND EFFECTOR INTERACTIONS. NATURE V. 503 548 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:203;
A:204;
Part of Protein;
Part of Protein;
none;
none;
submit data
40.078 Ca [Ca+2...
MG A:202;
Part of Protein;
none;
submit data
24.305 Mg [Mg+2...
GNP A:201;
Valid;
none;
submit data
522.196 C10 H17 N6 O13 P3 c1nc2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1CLU 1.7 Å EC: 3.6.5.2 H-RAS COMPLEXED WITH DIAMINOBENZOPHENONE-BETA,GAMMA-IMIDO-GT HOMO SAPIENS GTP HYDROLASE SIGNAL TRANSDUCTION CANCER G-DOMAIN HYDROL
Ref.: GUANOSINE TRIPHOSPHATASE STIMULATION OF ONCOGENIC R MUTANTS. PROC.NATL.ACAD.SCI.USA V. 96 7065 1999
Members (152)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 17 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 6ARK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
9 821P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
10 1Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
11 5VPZ - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
12 6F76 - CVK C24 H26 N2 O3 CN(C)Cc1cc....
13 6Q21 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
14 4L9W - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
15 4WA7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
16 3V4F - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
17 3K9N - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
18 5OCO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
19 4M1T - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
20 4XVQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
21 5V71 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
22 5VP7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
23 2QUZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
24 1CLU Kd = 5.4 nM DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
25 4L8G - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
26 5VBM - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
27 2RGD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
28 4PZY - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
29 4LPK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
30 4DLV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
31 4LRW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
32 2CLD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
33 4M1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
34 3L8Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
35 3LBH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
36 721P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
37 1LF5 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
38 1GNR - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
39 4LUC - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
40 2RGE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
41 4DLS - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
42 4M22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
43 4DLY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
44 1ZW6 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
45 2RGC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
46 5VQ1 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
47 5V9L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
48 2CL0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
49 4TQA - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
50 3RRZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
51 5VPY - 9GM C10 H17 N6 O13 P3 c1nc2c(n1[....
52 2EVW - XY2 C12 H15 N5 O4 CC(=O)N(C)....
53 2RGB - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
54 4LDJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
55 1XJ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
56 1ZVQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
57 5VQ6 - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
58 1P2S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
59 5V6V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
60 621P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
61 1P2V - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
62 2CL7 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
63 3OIW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
64 4LV6 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
65 4DLT - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
66 1P2U - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
67 5V6S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
68 5UK9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
69 6ASE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
70 3RS0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
71 5B30 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
72 5B2Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
73 3KKN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
74 4M1O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
75 5VQ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
76 4M1Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
77 5VPI - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
78 5W22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
79 3I3S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
80 4OBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
81 3RRY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
82 1QRA - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
83 6BP1 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
84 4LYJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
85 121P - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
86 1RVD - DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
87 5VBZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
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 5VQ8 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
100 4L9S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
101 6B0Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
102 4M1S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
103 4EPV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
104 5WDP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
105 4TQ9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
106 3K8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
107 3OIV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
108 5OCT - 9R5 C9 H10 Cl N O2 c1cc2c(cc1....
109 5VBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
110 4Q02 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
111 3LBI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
112 3RSL - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
113 1LF0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
114 1XCM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
115 421P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
116 4DLR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
117 2CE2 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
118 4QL3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
119 4Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
120 4DLU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
121 1CTQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
122 3OIU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
123 6B0V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
124 3RS5 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
125 4EPW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
126 5WDQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
127 1IOZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
128 221P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
129 4LYH - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
130 4DLX - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
131 4Q03 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
132 4PZZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
133 3KKM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
134 1JAI - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
135 3L8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
136 3RS4 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
137 3LBN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
138 4NMM - Y9Z C14 H22 N6 O12 P2 CC(=O)NCCO....
139 5VQ2 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
140 3RSO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
141 4XVR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
142 5P21 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
143 5F2E - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
144 4EPX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
145 4EPR - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
146 4DLW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
147 5WHD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
148 5V9O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
149 5V9U - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
150 2RGG - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
151 4LYF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
152 1JAH - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
70% Homology Family (173)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 10 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 6ARK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
9 821P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
10 1Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
11 5VPZ - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
12 6F76 - CVK C24 H26 N2 O3 CN(C)Cc1cc....
13 6Q21 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
14 4L9W - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
15 4WA7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
16 3V4F - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
17 3K9N - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
18 5OCO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
19 4M1T - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
20 4XVQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
21 5V71 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
22 5VP7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
23 2QUZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
24 1CLU Kd = 5.4 nM DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
25 4L8G - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
26 5VBM - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
27 2RGD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
28 4PZY - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
29 4LPK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
30 4DLV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
31 4LRW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
32 2CLD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
33 4M1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
34 3L8Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
35 3LBH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
36 721P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
37 1LF5 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
38 1GNR - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
39 4LUC - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
40 2RGE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
41 4DLS - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
42 4M22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
43 4DLY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
44 1ZW6 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
45 2RGC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
46 5VQ1 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
47 5V9L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
48 2CL0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
49 4TQA - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
50 3RRZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
51 5VPY - 9GM C10 H17 N6 O13 P3 c1nc2c(n1[....
52 2EVW - XY2 C12 H15 N5 O4 CC(=O)N(C)....
53 2RGB - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
54 4LDJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
55 1XJ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
56 1ZVQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
57 5VQ6 - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
58 1P2S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
59 5V6V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
60 621P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
61 1P2V - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
62 2CL7 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
63 3OIW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
64 4LV6 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
65 4DLT - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
66 1P2U - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
67 5V6S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
68 5UK9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
69 6ASE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
70 3RS0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
71 5B30 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
72 5B2Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
73 3KKN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
74 4M1O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
75 5VQ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
76 4M1Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
77 5VPI - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
78 5W22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
79 3I3S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
80 4OBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
81 3RRY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
82 1QRA - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
83 6BP1 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
84 4LYJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
85 121P - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
86 1RVD - DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
87 5VBZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
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 5VQ8 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
100 4L9S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
101 6B0Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
102 4M1S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
103 4EPV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
104 5WDP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
105 4TQ9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
106 3K8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
107 3OIV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
108 5OCT - 9R5 C9 H10 Cl N O2 c1cc2c(cc1....
109 5VBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
110 4Q02 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
111 3LBI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
112 3RSL - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
113 1LF0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
114 1XCM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
115 421P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
116 4DLR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
117 2CE2 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
118 4QL3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
119 4Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
120 4DLU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
121 1CTQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
122 3OIU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
123 6B0V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
124 3RS5 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
125 4EPW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
126 5WDQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
127 1IOZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
128 221P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
129 4LYH - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
130 4DLX - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
131 4Q03 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
132 4PZZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
133 3KKM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
134 1JAI - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
135 3L8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
136 3RS4 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
137 3LBN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
138 4NMM - Y9Z C14 H22 N6 O12 P2 CC(=O)NCCO....
139 5VQ2 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
140 3RSO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
141 4XVR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
142 5P21 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
143 5F2E - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
144 4EPX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
145 4EPR - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
146 4DLW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
147 5WHD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
148 5V9O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
149 5V9U - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
150 2RGG - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
151 4LYF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
152 1JAH - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
153 5US4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
154 5UQW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
155 5USJ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
156 4DSU - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
157 4DST - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
158 4DSO - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
159 4DSN - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
160 5OCG - 9R5 C9 H10 Cl N O2 c1cc2c(cc1....
161 1KAO - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
162 3RAP - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
163 1X1R - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
164 1X1S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
165 3X1Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
166 3X1Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
167 3X1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
168 3X1X - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
169 1U8Z - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
170 1U90 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
171 1U8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
172 5WDR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
173 5WDS - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
50% Homology Family (274)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 149 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 2WKR - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
17 2WKQ - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
18 5WDO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
19 3TGP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
20 1P2T - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
21 4Q01 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
22 4M21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
23 6ARK - 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 5VPZ - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
27 6F76 - CVK C24 H26 N2 O3 CN(C)Cc1cc....
28 6Q21 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
29 4L9W - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
30 4WA7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
31 3V4F - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
32 3K9N - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
33 5OCO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
34 4M1T - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
35 4XVQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
36 5V71 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
37 5VP7 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
38 2QUZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
39 1CLU Kd = 5.4 nM DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
40 4L8G - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
41 5VBM - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
42 2RGD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
43 4PZY - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
44 4LPK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
45 4DLV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
46 4LRW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
47 2CLD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
48 4M1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
49 3L8Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
50 3LBH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
51 721P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
52 1LF5 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
53 1GNR - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
54 4LUC - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
55 2RGE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
56 4DLS - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
57 4M22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
58 4DLY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
59 1ZW6 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
60 2RGC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
61 5VQ1 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
62 5V9L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
63 2CL0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
64 4TQA - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
65 3RRZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
66 5VPY - 9GM C10 H17 N6 O13 P3 c1nc2c(n1[....
67 2EVW - XY2 C12 H15 N5 O4 CC(=O)N(C)....
68 2RGB - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
69 4LDJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
70 1XJ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
71 1ZVQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
72 5VQ6 - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
73 1P2S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
74 5V6V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
75 621P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
76 1P2V - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
77 2CL7 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
78 3OIW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
79 4LV6 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
80 4DLT - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
81 1P2U - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
82 5V6S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
83 5UK9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
84 6ASE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
85 3RS0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
86 5B30 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
87 5B2Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
88 3KKN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
89 4M1O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
90 5VQ0 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
91 4M1Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
92 5VPI - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
93 5W22 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
94 3I3S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
95 4OBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
96 3RRY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
97 1QRA - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
98 6BP1 - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
99 4LYJ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
100 121P - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
101 1RVD - DBG C23 H27 N8 O13 P3 c1ccc(cc1)....
102 5VBZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
103 2RGA - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
104 3RS7 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
105 5UHV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
106 2CLC - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
107 4EPT - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
108 4EPY Kd = 340 uM 0QY C21 H21 N5 O c1ccc2c(c1....
109 4DLZ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
110 1AGP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
111 1GNQ - CAG C18 H23 N6 O16 P3 C[C@H](c1c....
112 2Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
113 3RS2 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
114 5VQ8 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
115 4L9S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
116 6B0Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
117 4M1S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
118 4EPV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
119 5WDP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
120 4TQ9 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
121 3K8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
122 3OIV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
123 5OCT - 9R5 C9 H10 Cl N O2 c1cc2c(cc1....
124 5VBE - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
125 4Q02 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
126 3LBI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
127 3RSL - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
128 1LF0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
129 1XCM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
130 421P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
131 4DLR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
132 2CE2 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
133 4QL3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
134 4Q21 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
135 4DLU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
136 1CTQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
137 3OIU - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
138 6B0V - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
139 3RS5 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
140 4EPW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
141 5WDQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
142 1IOZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
143 221P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
144 4LYH - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
145 4DLX - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
146 4Q03 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
147 4PZZ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
148 3KKM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
149 1JAI - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
150 3L8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
151 3RS4 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
152 3LBN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
153 4NMM - Y9Z C14 H22 N6 O12 P2 CC(=O)NCCO....
154 5VQ2 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
155 3RSO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
156 4XVR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
157 5P21 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
158 5F2E - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
159 4EPX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
160 4EPR - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
161 4DLW - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
162 5WHD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
163 5V9O - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
164 5V9U - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
165 2RGG - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
166 4LYF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
167 1JAH - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
168 1YU9 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
169 2BME - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
170 2BMD - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
171 1YZN - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
172 3RWM - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
173 3RWO - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
174 3REG - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
175 2F9L - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
176 2F9M - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
177 1YZK - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
178 1OIV - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
179 2FE4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
180 2FFQ - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
181 2E9S - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
182 5US4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
183 5UQW - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
184 5USJ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
185 3NKV - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
186 1HUQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
187 1Z07 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
188 1N6R - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
189 1Z0D - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
190 1N6H - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
191 1N6P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
192 1N6K - GDP AF3 n/a n/a
193 1N6N - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
194 1N6I - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
195 1R2Q - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
196 1N6L - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
197 1N6O - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
198 1TU4 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
199 1EK0 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
200 1S8F - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
201 1YZL - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
202 1WMS - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
203 1D5C - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
204 1Z0F - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
205 3E5H - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
206 4DSU - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
207 4DST - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
208 4DSO - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
209 4DSN - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
210 5OCG - 9R5 C9 H10 Cl N O2 c1cc2c(cc1....
211 1KAO - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
212 3RAP - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
213 1YZQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
214 2GIL - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
215 1Z0A - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
216 1KY2 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
217 1KY3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
218 2HT6 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
219 3KKO - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
220 3KKQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
221 3KKP - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
222 1X1R - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
223 1X1S - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
224 1T91 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
225 1VG8 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
226 2GCP - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
227 2GCN - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
228 3X1Z - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
229 3X1Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
230 3X1W - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
231 3X1X - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
232 4Z8Y - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
233 1G17 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
234 1G16 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
235 1M7B - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
236 2DPX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
237 3Q7Q - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
238 3Q7P - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
239 3Q72 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
240 1U8Z - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
241 1U90 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
242 1U8Y - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
243 1YVD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
244 5WDR - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
245 5WDS - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
246 1Z06 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
247 3TH5 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
248 3SBD - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
249 1OIX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
250 1OIW - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
251 2QRZ - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
252 1A4R Kd = 9.4 pM GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
253 1KMQ - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
254 1DPF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
255 1FTN - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
256 5A0F - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
257 1A2B - GSP C10 H16 N5 O13 P3 S c1nc2c(n1[....
258 4U5X - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
259 3Q85 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
260 1RYH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
261 1RYF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
262 1VG1 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
263 5XC5 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
264 5XC3 - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
265 3RAB - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
266 1GWN - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
267 2EW1 - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
268 4O25 - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
269 4O2R - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
270 4O2L - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
271 6BSX - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
272 5YXH - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
273 1XTQ - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
274 3SEA - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GNP; Similar ligands found: 132
No: Ligand ECFP6 Tc MDL keys Tc
1 GNP 1 1
2 9GM 1 1
3 GDP 0.839506 0.973684
4 GP3 0.82716 0.948718
5 GTP 0.809524 0.973684
6 GNH 0.807229 0.986842
7 G1R 0.77907 0.961039
8 GCP 0.77907 0.948718
9 GSP 0.770115 0.925
10 5GP 0.756098 0.960526
11 G 0.756098 0.960526
12 G2R 0.747253 0.936709
13 GMV 0.747126 0.948718
14 GAV 0.714286 0.936709
15 GP2 0.712644 0.936709
16 G2P 0.711111 0.936709
17 Y9Z 0.708333 0.880952
18 GDC 0.690722 0.936709
19 GDD 0.690722 0.936709
20 GKE 0.690722 0.936709
21 G5P 0.686869 0.948718
22 GPG 0.684211 0.936709
23 GTG 0.683673 0.91358
24 GDR 0.683673 0.936709
25 GFB 0.683673 0.936709
26 JB2 0.68 0.936709
27 GKD 0.68 0.936709
28 6CK 0.676768 0.91358
29 G3A 0.676768 0.948718
30 GDX 0.673267 0.948718
31 ALF 5GP 0.67033 0.86747
32 YGP 0.663265 0.879518
33 GPD 0.656863 0.902439
34 ALF GDP 0.645833 0.86747
35 GDP AF3 0.645833 0.86747
36 GDP ALF 0.645833 0.86747
37 JB3 0.641509 0.925
38 DBG 0.640351 0.974359
39 G3D 0.638298 0.960526
40 G4P 0.625 0.960526
41 GMP 0.621951 0.857143
42 NGD 0.62037 0.936709
43 GGM 0.618182 0.925926
44 0O2 0.616162 0.960526
45 2MD 0.603604 0.870588
46 CAG 0.60177 0.904762
47 U2G 0.590909 0.91358
48 FEG 0.590909 0.858824
49 GDP 7MG 0.590476 0.888889
50 MGD 0.587719 0.870588
51 G G 0.586538 0.924051
52 ZGP 0.585586 0.848837
53 CG2 0.580357 0.91358
54 ANP 0.568421 0.922078
55 PGD 0.567797 0.902439
56 MD1 0.567797 0.870588
57 3GP 0.56044 0.922078
58 TPG 0.558333 0.822222
59 GH3 0.55 0.948052
60 FE9 0.546219 0.778947
61 GPX 0.539216 0.922078
62 G4M 0.539062 0.860465
63 DGI 0.536082 0.9
64 BGO 0.535088 0.901235
65 IDP 0.53125 0.947368
66 DGT 0.53 0.9
67 2GP 0.526882 0.935065
68 G1R G1R 0.520325 0.901235
69 GCP G 0.518868 0.897436
70 A G 0.516949 0.911392
71 U A G G 0.512605 0.911392
72 G A A A 0.504202 0.9
73 AGO 0.504202 0.91358
74 P2G 0.5 0.860759
75 G1G 0.5 0.902439
76 R7I 0.49505 0.922078
77 MGP 0.49505 0.936709
78 R5I 0.49505 0.922078
79 PGD O 0.492063 0.831461
80 6G0 0.490196 0.936709
81 P1G 0.489796 0.85
82 AKW 0.483051 0.869048
83 DG 0.474227 0.8875
84 DGP 0.474227 0.8875
85 G U 0.466667 0.878049
86 IMP 0.463918 0.934211
87 G2Q 0.462963 0.936709
88 GPC 0.459677 0.858824
89 G C 0.459016 0.878049
90 GTA 0.448276 0.91358
91 G7M 0.444444 0.924051
92 MAP 0.439252 0.898734
93 G G G RPC 0.435484 0.853659
94 B4P 0.434343 0.871795
95 AP5 0.434343 0.871795
96 ADP 0.434343 0.896104
97 A2D 0.43299 0.871795
98 AT4 0.43 0.8625
99 G G G C 0.426357 0.890244
100 AU1 0.425743 0.922078
101 SGP 0.425743 0.807229
102 BA3 0.424242 0.871795
103 A G C C 0.423077 0.888889
104 35G 0.423077 0.909091
105 PCG 0.423077 0.909091
106 C2E 0.423077 0.897436
107 APC G U 0.421875 0.864198
108 HEJ 0.421569 0.896104
109 ATP 0.421569 0.896104
110 ACQ 0.419048 0.873418
111 5GP 5GP 0.419048 0.860759
112 5FA 0.417476 0.896104
113 AQP 0.417476 0.896104
114 01G 0.417391 0.880952
115 AN2 0.415842 0.909091
116 UNP 0.415842 0.810127
117 6AD 0.415094 0.821429
118 M33 0.411765 0.860759
119 ITT 0.411765 0.846154
120 G C C C 0.410448 0.901235
121 HFD 0.409524 0.851852
122 G U34 0.408 0.86747
123 ACP 0.407767 0.873418
124 6YZ 0.407407 0.873418
125 AR6 0.403846 0.871795
126 APR 0.403846 0.871795
127 DG DG 0.403509 0.845238
128 A4P 0.403226 0.848837
129 UCG 0.402985 0.888889
130 SAP 0.4 0.851852
131 AGS 0.4 0.851852
132 AD9 0.4 0.873418
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1CLU; Ligand: DBG; Similar sites found with Apoc: 596
This union binding pocket(no: 1) in the query (biounit: 1clu.bio1) has 47 residues
No: Leader PDB Ligand Sequence Similarity
1 2X77 GDP None
2 3N5C GDP None
3 1UPT GTP None
4 2W58 ADP None
5 4KAX GTP None
6 2Y65 ADP None
7 4RZ3 ADP None
8 1GXU 2HP None
9 1Y7P RIP None
10 3CBC DBS None
11 2BVE PH5 None
12 1OYJ GSH None
13 2VDF OCT None
14 6B79 ORA None
15 4NS0 PIO None
16 5KK4 44E None
17 4Z7X 3CX None
18 3RF4 FUN None
19 1FHX 4IP None
20 5H9P TD2 None
21 2DTJ THR None
22 4KAX 4IP None
23 1SQL GUN None
24 1A78 TDG None
25 4GBM A3P 1.20482
26 2B4B COA 1.20482
27 3COB ADP 1.80723
28 1R0X ATP 1.80723
29 1XP8 AGS 1.80723
30 1NJF ADP 1.80723
31 1NJF AGS 1.80723
32 3KC1 2T6 1.80723
33 4L4J NAG NAG BMA MAN NAG 1.80723
34 1P72 ADP 1.80723
35 2W5P CL8 2.01342
36 6GNO XDI 2.22222
37 2ZFI ADP 2.40964
38 5M7P ADP 2.40964
39 2DT9 THR 2.40964
40 5ZB0 ADP 2.40964
41 5ZB0 TYD 2.40964
42 1JG9 GLC 2.40964
43 1I7M CG 2.40964
44 2JLD ALA GLY GLY ALA ALA ALA ALA ALA 2.40964
45 6G47 SIA SIA 2.40964
46 5H2U 1N1 2.40964
47 5F7N NAG GAL FUC FUC A2G 2.5
48 1HTW ADP 2.53165
49 1DCP HBI 2.88462
50 3H4S ADP 3.01205
51 4FRZ ADP 3.01205
52 1ION ADP 3.01205
53 1G41 ADP 3.01205
54 1OFH ADP 3.01205
55 5FTB ANP 3.01205
56 5YJS SAL 3.01205
57 5EE5 GTP 3.01205
58 2OZE AGS 3.01205
59 6C90 ADP 3.01205
60 5EXT ADP 3.01205
61 1YTM ATP 3.01205
62 5FHD ADP ALF 3.01205
63 5HCN GCP 3.01205
64 1SDW IYT 3.01205
65 1VKJ A3P 3.01205
66 3GDN MXN 3.01205
67 3TMK T5A 3.01205
68 1L2T ATP 3.01205
69 3QPB URA 3.01205
70 4CR6 MAN 3.01205
71 5XQW 8EU 3.01205
72 2Q2Y MKR 3.01205
73 2Q2Y ADP 3.01205
74 2VHJ ADP 3.01205
75 1B0U ATP 3.05344
76 2G30 ALA ALA PHE 3.61446
77 6A20 ADP 3.61446
78 1M7G AV2 3.61446
79 2PL3 ADP 3.61446
80 4TTQ ATP 3.61446
81 4ZNL BEF ADP 3.61446
82 5GVR LMR 3.61446
83 2QEN ADP 3.61446
84 4QRH 0O2 3.61446
85 2FSH ANP 3.61446
86 1KO8 6PG 3.61446
87 6B4K ANP 3.61446
88 1TQ4 GDP 3.61446
89 4YS0 ADP 3.61446
90 1W0H AMP 3.61446
91 1M7G ADP 3.61446
92 1M7G ADX 3.61446
93 2R0D 4IP 3.61446
94 5H9Y BGC BGC BGC BGC 3.61446
95 3SAO DBH 3.75
96 5F6U 5VK 3.82166
97 5URY PAM 4.10959
98 4RF7 ARG 4.21687
99 2GKS ADP 4.21687
100 5L3W GDP 4.21687
101 4E03 ADP 4.21687
102 5UIV ADP 4.21687
103 5N69 ADP 4.21687
104 2DPY ADP 4.21687
105 5KJW 53C 4.21687
106 1VHT BA3 4.21687
107 4KBF AMP 4.21687
108 1YXM ADE 4.21687
109 5VHC BEF ADP 4.21687
110 2J5V PCA 4.21687
111 5LKC FUC GLA A2G 4.21687
112 2O0J ADP 4.21687
113 3QSB 743 4.21687
114 2Z49 AMG 4.21687
115 2Z48 NGA 4.21687
116 3GD9 GLC BGC BGC BGC 4.21687
117 2Z48 A2G 4.21687
118 1OE0 TTP 4.21687
119 1P3D ANP 4.21687
120 2WE0 UMP 4.21687
121 4BG4 ADP 4.21687
122 2IYL GDP 4.22535
123 5NLD LBT 4.31655
124 3KIF GDL 4.71698
125 4LC1 GDP 4.81928
126 2XT3 ADP 4.81928
127 3DC4 ADP 4.81928
128 1F9V ADP 4.81928
129 3BFV ADP 4.81928
130 1JI0 ATP 4.81928
131 4JLV ADP 4.81928
132 5I34 GDP 4.81928
133 5TSH ADP 4.81928
134 5TSH ANP 4.81928
135 4PX9 ADP 4.81928
136 1G6O ADP 4.81928
137 3BOS CDP 4.81928
138 1FNN ADP 4.81928
139 5G48 1FL 4.81928
140 6DZN AE3 4.81928
141 3B7G ANP 4.81928
142 5Z69 AGS 4.81928
143 4OHY ANP 4.81928
144 1KSH GDP 4.81928
145 5XDR ADP 4.81928
146 1G51 AMP 4.81928
147 1AQU A3P 4.81928
148 4GOX A3P 4.81928
149 5FAG PPI 4.81928
150 6H5E ANP 4.81928
151 3IUY AMP 4.81928
152 4G86 BNT 4.81928
153 1PDZ PGA 4.81928
154 1DAK ADP 4.81928
155 1DAK DPU 4.81928
156 5CX8 TG6 4.81928
157 2Q8M AMP 4.81928
158 4NS3 NAD 4.81928
159 2JAQ DCP 4.81928
160 2YOH WMJ 4.81928
161 4UP4 GAL NAG 4.81928
162 1NU4 MLA 5.15464
163 6E2B PT7 5.26316
164 2KIN ADP 5.42169
165 1T5C ADP 5.42169
166 1G6H ADP 5.42169
167 4YDS ATP 5.42169
168 3FWY ADP 5.42169
169 3UIE ANP 5.42169
170 3Q9L ATP 5.42169
171 2OG2 MLI 5.42169
172 5L3R GCP 5.42169
173 3B9Q MLI 5.42169
174 5I0H ADP BEF 5.42169
175 1Z6T ADP 5.42169
176 1P9B GDP 5.42169
177 5K5Z ANP 5.42169
178 3QXC ATP 5.42169
179 2BEK ATP 5.42169
180 4RUS NAG 5.42169
181 1QHG ATP 5.42169
182 5AHO TLA 5.42169
183 5H68 AGS 5.42169
184 1NN5 ANP 5.42169
185 1NN5 2DT 5.42169
186 2OJW ADP 5.42169
187 2QG6 NMN 5.42169
188 4RYV ZEA 5.80645
189 5KUT GDP 6.0241
190 4RD0 GDP 6.0241
191 2A5F GTP 6.0241
192 5U32 GDP 6.0241
193 3NHB ADP 6.0241
194 5ZXD ATP 6.0241
195 5WC2 ADP 6.0241
196 5LB3 ADP 6.0241
197 2QZ4 ADP 6.0241
198 3IO3 ADP 6.0241
199 2OBM ADP 6.0241
200 5J1J ANP 6.0241
201 3DKP ADP 6.0241
202 4D81 ADP 6.0241
203 5Y6N ADP 6.0241
204 1W7J ADP BEF 6.0241
205 3ZS9 ADP ALF 6.0241
206 2B8W ALF 5GP 6.0241
207 2WOJ ADP ALF 6.0241
208 1F5N GNP 6.0241
209 4YJ1 ADP 6.0241
210 3FVQ ATP 6.0241
211 1OFL NGK GCD 6.0241
212 3VM7 GLC 6.0241
213 3JQ3 ADP 6.0241
214 3L6C MLI 6.0241
215 2Z5F A3P 6.0241
216 3QKT ANP 6.0241
217 2GVJ DGB 6.0241
218 2AGC DAO 6.17284
219 4Y4V DAL 6.19469
220 3H86 AP5 6.25
221 5L83 ASP TRP GLU ILE VAL 6.25
222 3WYA GDP 6.45161
223 3WY9 GDP 6.45161
224 2HCJ GDP 6.62651
225 3U6B GDP 6.62651
226 2BVN GNP 6.62651
227 1D8T GDP 6.62651
228 5JBQ GDP 6.62651
229 3U6K GDP 6.62651
230 4LPS GDP 6.62651
231 3WXM GTP 6.62651
232 1G7C 5GP 6.62651
233 4WZ6 ATP 6.62651
234 2PZE ATP 6.62651
235 2Z3U CRR 6.62651
236 1FP6 ADP 6.62651
237 1SQ5 ADP 6.62651
238 2CE7 ADP 6.62651
239 4R43 GDP 6.62651
240 2FAH GDP 6.62651
241 2FNA ADP 6.62651
242 5MZN ADP 6.62651
243 4QOS ADP 6.62651
244 1IN4 ADP 6.62651
245 2ZPA ADP 6.62651
246 4ZDJ UTP 6.62651
247 2YKL NLD 6.62651
248 6A46 DCM 6.62651
249 3RC3 ANP 6.62651
250 4G5G GDP 6.62651
251 4GLW NMN 6.62651
252 2GWH A3P 6.62651
253 3AB4 THR 6.62651
254 3AB4 LYS 6.62651
255 3CV3 UDP 6.62651
256 4WOP CTP 6.66667
257 1F2U ATP 6.71141
258 2P7Q GG6 6.76692
259 5W7Q GDP 7.22892
260 5W76 GDP 7.22892
261 5W75 GDP 7.22892
262 6G14 G4P 7.22892
263 2C77 GNP 7.22892
264 1GOJ ADP 7.22892
265 2CBZ ATP 7.22892
266 3PCR GTP 7.22892
267 3A4M ADP 7.22892
268 1RRC ADP 7.22892
269 1WDT GTP 7.22892
270 4AG5 ADP 7.22892
271 5YV5 ADP 7.22892
272 1YQT ADP 7.22892
273 2HF9 GSP 7.22892
274 3ZFD ANP 7.22892
275 1R6B ADP 7.22892
276 5IRN ADP 7.22892
277 2C78 GNP 7.22892
278 1U0J ADP 7.22892
279 4PFO ADP 7.22892
280 2XAU ADP 7.22892
281 6B8B ADP 7.22892
282 2X7I CIT 7.22892
283 4OI4 ATP 7.22892
284 6FAA ADP 7.22892
285 2PEZ GGZ 7.22892
286 2PEZ DAT 7.22892
287 2OFW ADX 7.22892
288 2VB6 ADP BEF 7.38255
289 3CNL GNP 7.83133
290 4R98 GNH 7.83133
291 1LVG ADP 7.83133
292 1FQJ GDP 7.83133
293 1FQK GDP 7.83133
294 2WHX ADP 7.83133
295 2XTN GTP 7.83133
296 4H1V GNP 7.83133
297 3IIJ ADP 7.83133
298 3E70 GDP 7.83133
299 1OXV ANP 7.83133
300 3EZ2