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TitleStructure-Function Analysis of Mammalian CYP2B Enzymes Using 7-Substituted Coumarin Derivatives as Probes: Utility of Crystal Structures and Molecular Modeling in Understanding Xenobiotic Metabolism.
Journal, issue, pagesMol. Pharmacol., Vol. 89, Page 435-445, Year 2016
Publish dateSep 28, 2015 (structure data deposition date)
AuthorsShah, M.B. / Liu, J. / Huo, L. / Zhang, Q. / Dearing, M.D. / Wilderman, P.R. / Szklarz, G.D. / Stout, C.D. / Halpert, J.R.
External linksMol. Pharmacol. / PubMed:26826176
MethodsX-ray diffraction
Resolution2.4 - 3.4 Å
Structure data

PDB-5e0e:
Crystal Structure of Cytochrome P450 2B37 from Desert Woodrat in complex with 4-(4-chlorophenyl)imidazole
Method: X-RAY DIFFRACTION / Resolution: 3.4 Å

PDB-5e58:
Crystal Structure Of Cytochrome P450 2B35 from Desert Woodrat Neotoma Lepida in complex with 4-(4-chlorophenyl)imidazole
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-CPZ:
4-(4-CHLOROPHENYL)IMIDAZOLE

ChemComp-HOH:
WATER

ChemComp-CM5:
5-CYCLOHEXYL-1-PENTYL-BETA-D-MALTOSIDE / detergent*YM

ChemComp-GOL:
GLYCEROL

Source
  • neotoma lepida (desert woodrat)
KeywordsOxidoreductase/Oxidoreductase inhibitor / Cytochrome P450 / CYP2B37 / 4-(4-chlorophenyl)imidazole / Inhibitor / Oxidoreductase-Oxidoreductase inhibitor complex / OXIDOREDUCTASE / Cytochrome P450; CYP2B35; Neotoma Lepida; Woodrat

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