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TitleDesign and synthesis of selective CYP1B1 inhibitor via dearomatization of alpha-naphthoflavone.
Journal, issue, pagesBioorg. Med. Chem., Vol. 27, Page 285-304, Year 2019
Publish dateNov 6, 2018 (structure data deposition date)
AuthorsKubo, M. / Yamamoto, K. / Itoh, T.
External linksBioorg. Med. Chem. / PubMed:30553624
MethodsX-ray diffraction
Resolution3.7 Å
Structure data

PDB-6iq5:
Crystal Structure of CYP1B1 and Inhibitor Having Azide Group
Method: X-RAY DIFFRACTION / Resolution: 3.7 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-AQ0:
2-(cis-4-azidocyclohexyl)-4H-naphtho[1,2-b]pyran-4-one

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / Cytochrome P450 / Inhibitor / CYP1B1 / azide / OXIDOREDUCTASE / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex

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