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TitleA Novel Class of Highly Potent Irreversible Hepatitis C Virus NS5B Polymerase Inhibitors.
Journal, issue, pagesJ. Med. Chem., Vol. 55, Page 2089-2101, Year 2012
Publish dateSep 26, 2011 (structure data deposition date)
AuthorsChen, K.X. / Lesburg, C.A. / Vibulbhan, B. / Yang, W. / Chan, T.Y. / Venkatraman, S. / Velazquez, F. / Zeng, Q. / Bennett, F. / Anilkumar, G.N. ...Chen, K.X. / Lesburg, C.A. / Vibulbhan, B. / Yang, W. / Chan, T.Y. / Venkatraman, S. / Velazquez, F. / Zeng, Q. / Bennett, F. / Anilkumar, G.N. / Duca, J. / Jiang, Y. / Pinto, P. / Wang, L. / Huang, Y. / Selyutin, O. / Gavalas, S. / Pu, H. / Agrawal, S. / Feld, B. / Huang, H.C. / Li, C. / Cheng, K.C. / Shih, N.Y. / Kozlowski, J.A. / Rosenblum, S.B. / Njoroge, F.G.
External linksJ. Med. Chem. / PubMed:22247956
MethodsX-ray diffraction
Resolution1.6 Å
Structure data

PDB-3tyq:
SAR development and discovery of potent indole-based inhibitors of the hepatitis c virus NS5B polymerase
Method: X-RAY DIFFRACTION / Resolution: 1.6 Å

Chemicals

ChemComp-HI4:
5-ethyl-1-(2-fluoro-5-nitrobenzyl)-3-(2-oxo-1,2-dihydropyridin-3-yl)-1H-indole-2-carboxylic acid

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

Source
  • hepatitis c virus
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / RNA-dependent RNA polymerase / TRANSFERASE-TRANSFERASE INHIBITOR complex

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