Investigation of the mode of binding of a novel series of N-benzyl-4-heteroaryl-1-(phenylsulfonyl)piperazine-2-carboxamides to the hepatitis C virus polymerase

Bioorganic and Medicinal Chemistry Letters

Volumn 21, Issue 8, 2011, Pages 2212-2215

  Gentles, Robert G ^a   Sheriff, Steven ^a   Beno, Brett R ^a   Wan, Changhong ^a   Kish, Kevin ^a   Ding, Min ^a   Zheng, Xiaofan ^a   Chupak, Louis ^a   Poss, Michael A ^a   Witmer, Mark R ^a   Morin, Paul ^a   Wang, Ying Kai ^a   Rigat, Karen ^a   Lemm, Julie ^a   Voss, Stacey ^a   Liu, Mengping ^a   Pelosi, Lenore ^a   Roberts, Susan B ^a   Gao, Min ^a   Kadow, John F ^a  

^a BRISTOL MYERS SQUIBB   (United States)

Author keywords

Antiviral; Co crystal; HCV; Inhibitor; NS5B; Polymerase; Structure

Indexed keywords

NONSTRUCTURAL PROTEIN 5B; PIPERAZINE DERIVATIVE;

ANTIVIRAL ACTIVITY; ARTICLE; CRYSTAL STRUCTURE; DRUG STRUCTURE; ENZYME INHIBITION; GENOTYPE; HEPATITIS C VIRUS; NONHUMAN; STRUCTURE ACTIVITY RELATION;

AMIDES; ANTIVIRAL AGENTS; BINDING SITES; COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; ENZYME INHIBITORS; HEPACIVIRUS; VIRAL NONSTRUCTURAL PROTEINS;

HEPATITIS C VIRUS;

EID: 79953270504     PISSN: 0960894X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmcl.2011.03.011     Document Type: Article

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16. Compound 4 bound to NS5B 1b, Bartenschlager construct: PDB 3QGF.
17. Compound 2 bound to NS5B 1a, PDB 3QGI.
18. Compound 5 bound to NS5B 1b, Bartenschlager construct: PDB 3QGG.
19. Compound 5 bound to NS5B 1a, PDB 3QGH.