7WY3

Structure of the Oxomolybdenum Mesoporphyrin IX-Reconstituted CYP102A1 F87V Mutant Haem Domain with N-(5-Cyclohexyl)valeroyl-L-Phenylalanine in complex with Styrene

Summary for 7WY3

Entry DOI	10.2210/pdb7wy3/pdb
Descriptor	Bifunctional cytochrome P450/NADPH--P450 reductase, Oxomolybdenum Mesoporphyrin IX, (2~{S})-2-(5-cyclohexylpentanoylamino)-3-phenyl-propanoic acid, ... (7 entities in total)
Functional Keywords	monooxygenase, oxidoreductase
Biological source	Priestia megaterium
Total number of polymer chains	2
Total formula weight	108089.88
Authors	Suzuki, K.,Stanfield, J.K.,Shisaka, Y.,Omura, K.,Kasai, C.,Sugimoto, H.,Shoji, O. (deposition date: 2022-02-15, release date: 2023-01-04, Last modification date: 2023-11-29)
Primary citation	Suzuki, K.,Stanfield, J.K.,Omura, K.,Shisaka, Y.,Ariyasu, S.,Kasai, C.,Aiba, Y.,Sugimoto, H.,Shoji, O. A Compound I Mimic Reveals the Transient Active Species of a Cytochrome P450 Enzyme: Insight into the Stereoselectivity of P450-Catalysed Oxidations. Angew.Chem.Int.Ed.Engl., 62:e202215706-e202215706, 2023 Cited by PubMed: 36519803 DOI: 10.1002/anie.202215706 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.6 Å)

Structure validation