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TitleSolution structure of a last generation macrocyclic inhibitor. Hepatitis C virus NS3 protease complex: when S prime region occupancy is not enough to stabilize the protein conformation in the absence of NS4A.
Journal, issue, pagesTo Be Published
Publish dateDec 29, 2017 (structure data deposition date)
AuthorsGallo, M. / Eliseo, T. / Monteagudo, E.S. / Sabetta, S. / Paci, M. / Summa, V. / Cicero, D.O.
External linksSearch PubMed
MethodsNMR (solution)
Structure data

PDB-6fe6:
Solution structure of a last generation P2-P4 macrocyclic inhibitor
Method: SOLUTION NMR

Chemicals

ChemComp-4P2:
(3aR,7S,10S,12R,24aR)-7-cyclopentyl-N-{(1R,2S)-1-[(cyclopropylsulfonyl)carbamoyl]-2-ethenylcyclopropyl}-5,8-dioxo-1,2,3,3a,5,6,7,8,11,12,20,21,22,23,24,24a-hexadecahydro-10H-9,12-methanocyclopenta[18,19][1,10,3,6]dioxadiazacyclononadecino[12,11-b]quinoline-10-carboxamide

ChemComp-ZN:
Unknown entry

Source
  • hepatitis c virus subtype 1b
KeywordsVIRAL PROTEIN / NS3 Protease / Inhibitor / Complex / HCV

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