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EBI PDBe PDBeView

PDBe Entry: 2fdu view

Microsomal P450 2A6 with the inhibitor N,N-Dimethyl(5-(pyridin-3-yl)furan-2-yl)methanamine bound
Summary
Header OXIDOREDUCTASEsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 1.85 Å, R-factor: 18.8%, Free R-factor: 22.3%, Spacegroup: P 1 21 1
Released 28/11/2006, deposition: 14/12/2005, last revision: 24/02/2009
Authors Yano, J.K.search; Stout, C.D.search; Johnson, E.F.search
Primary citation Synthetic Inhibitors of Cytochrome P-450 2A6: Inhibitory Activity, Difference Spectra, Mechanism of Inhibition, and Protein Cocrystallization.
J.MED.CHEM.search vol:49, pag:6987-7001 (2006) [PubMed ID 17125252 ]search
Keywords CYP2A6search, P450 2A6search, P450search, MONOOXYGENASEsearch, DRUG METABOLIZING ENZYMEsearch, COUMARIN 7-HYDROXYLASEsearch, NICOTINE OXIDASEsearch, OXIDOREDUCTASEsearch
EC 1.14.14.1 ExPASy BRENDA search (A B C D)
Organism Homo sapiens(human) 9606search(A B C D)
UniProt Cytochrome P450 2A6 (EC 1.14.14.1) (CYPIIA6) (Coumarin 7-hydroxylase) (P450 IIA3) (CYP2A3) (P450(I)) P11509search (A B C D)
Solvent A, B, C, D
Related entries 1z10, 1z11, 2fdv, 2fdw, 2fdy
Polymers
Id Name Type UniProt Residues Observed
A, B, C, D Cytochrome P450 2A6 Protein P11509 (CP2A6_HUMAN)search
 476 97%
Heterogens
Id Name Ligands
A SULFATE ION SO4 search
A, B, C, D PROTOPORPHYRIN IX CONTAINING FE HEM search
A, B, C, D N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE D1G search
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