Receptor
PDB id Resolution Class Description Source Keywords
2jc1 2 Å EC: 2.7.7.48 CRYSTAL STRUCTURE OF HEPATITIS C VIRUS POLYMERASE IN COMPLEX WITH INHIBITOR SB698223 HEPATITIS C VIRUS HEPATITIS POLYMERASE HYDROLASE
Ref.: OPTIMIZATION OF NOVEL ACYL PYRROLIDINE INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE LEADING TO A DEVELOPMENT CANDIDATE. J.MED.CHEM. V. 50 897 2007
Ligand Information
Ligand Validity Binding Data Ligand Warnings Chemaxon Viewer Molecular Weight (Da) Formula SMILES
698 Valid ic50 = 3.8 uM none 458.57
C24 H30 N2 O5 S
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c2ccc(cc2)C(C)(C)C)c3nccs3)C(=O)O)C(=O)O
90% Homology Family

The Class containing this family consists of a total of 8 families.

Leader:    3GNW     HCV NS5B POLYMERASE IN COMPLEX WITH 1,5 BENZODIAZEPINE INHIB
No: PDB id Binding Data Representative ligand
1 1OS5 Kd = 0.14 uM NH1
2 3CO9 - 3MS
3 3CJ3 ic50 = 57 uM SX4
4 3U4R ic50 = 0.039 uM 08F
5 3UDL - KLI
6 3GNW Kd = 0.79 nM XNC
7 3CJ5 ic50 = 0.25 uM SX6
8 3SKA ic50 = 0.017 uM 053
9 2JC0 ic50 = 20 uM 699
10 2GIR ic50 = 140 nM NN3
11 3HHK ic50 = 6 nM 77Z
12 3UPI ic50 = 6 nM 0C2
13 3TYV ic50 = 0.008 uM HI3
14 3H2L - YAK
15 3D28 ic50 = 1.4 uM B34
16 3CIZ - SX1
17 3HKY Kd = 2.3 nM IX6
18 2O5D ic50 = 7 uM VR1
19 3PHE ic50 = 0.016 uM C9A
20 3CJ2 ic50 = 17 uM SX3
21 3CWJ ic50 < 0.01 uM 321
22 3FQK ic50 = 0.081 uM 79Z
23 3BSA - 1PD
24 2WHO ic50 = 0.02 uM VGI
25 3LKH ic50 = 0.8 uM LT6
26 4EO6 Kd = 0.002 uM 0S2
27 2D3Z ic50 = 0.2918 uM FIH
28 4EO8 Kd = 0.007 uM 0S3
29 3FQL Kd = 0.071 uM 79Z
30 3CJ4 ic50 = 1 uM SX5
31 3GYN ic50 = 0.047 uM B42
32 3G86 ic50 = 0.005 uM T18
33 3QGF - 46F
34 2JC1 ic50 = 3.8 uM 698
35 4DRU Kd = 2.4 nM 0LN
36 2GC8 ic50 = 3.1 uM 885
37 2I1R ic50 = 9.7 uM VXR
38 2D41 ic50 = 0.31 uM SNH
39 2WCX ic50 = 0.025 uM VGC
40 1GX5 - GTP
41 2HWH ic50 = 2 uM RNA
42 3H59 - H59
43 3H5U ic50 = 0.003 uM H5U
44 3Q0Z - 23E
45 1NHU Ki = 2.2 uM 153
46 2DXS ic50 = 0.046 uM JTP
47 3D5M ic50 < 0.01 uM 4MS
48 1GX6 - UTP
49 3U4O ic50 = 0.053 uM 08E
50 3E51 ic50 = 0.014 uM N35
51 2GIQ ic50 = 131 nM NN2
52 2D3U Ki = 0.12 uM CCT
53 2FVC ic50 = 32 nM 888
54 3H98 ic50 < 0.005 uM B5P
55 3BR9 ic50 = 0.062 uM DEY
56 3SKH ic50 = 0.9 uM 058
57 2HWI ic50 = 3 uM VRX
58 3VQS ic50 = 0.0178 uM JT1
59 1YVF ic50 = 0.1 uM PH7
60 2BRK - CMF
61 2BRL - POO
62 3CDE ic50 < 0.01 uM N3H
63 2HAI ic50 = 0.53 uM PFI
64 3CJ0 - SX2
65 3FRZ - AG0
66 3CVK ic50 < 0.01 uM N34
67 3SKE ic50 = 0.032 uM 054
68 3MF5 ic50 = 0.042 uM HJZ
69 3H5S ic50 = 0.005 uM H5S
70 3UPH ic50 = 15 nM 0C1
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