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3SKH

I. Novel HCV NS5B Polymerase Inhibitors: Discovery of Indole 2- Carboxylic Acids with C3-Heterocycles

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, B
(A, B)
HCV NS5B RNA_DEPENDENT RNA POLYMERASEpolymer57664191.62UniProt (O92972)
Pfam (PF00998)
Hepatitis C virus isolate HC-J4 (HCV)RNA-directed RNA polymerase, NS5B
2C, D
(A, B)
1-benzyl-5-chloro-3-(2-fluorophenyl)-1H-indole-2-carboxylic acidnon-polymer379.82Chemie (058)
3E, F
(A, B)
waterwater18.0450Chemie (HOH)
Sequence modifications
A, B: 1 - 570 (UniProt: O92972)
PDBExternal DatabaseDetails
Gly 440Glu 2859conflict
Ile 520Thr 2939conflict
Glu 571-expression tag
Asn 572-expression tag
Leu 573-expression tag
Tyr 574-expression tag
Phe 575-expression tag
Gln 576-expression tag
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains2
Total formula weight128383.2
Non-Polymers*Number of molecules2
Total formula weight759.6
All*Total formula weight129142.8
*Water molecules are not included.

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PDB entries from 2025-07-16

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