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TitleDiscovery of a Novel Binding Pocket for Cyp 2C9 Inhibitors: Crystallography, Pharmacophore Modelling and Inhibitor Sar.
Journal, issue, pagesMed. Chem. Comm., Vol. 7, Page 813-, Year 2016
Publish dateJun 18, 2015 (structure data deposition date)
AuthorsSkerratt, S.E. / de Groot, M.J. / Phillips, C.
External linksMed. Chem. Comm. / Search PubMed
MethodsX-ray diffraction
Resolution2 Å
Structure data

PDB-5a5i:
Cytochrome 2C9 P450 inhibitor complex
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-XI1:
N-[4-(3-chloranyl-4-cyano-phenoxy)cyclohexyl]-1,1,1-tris(fluoranyl)methanesulfonamide

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE

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