7EGN

Crystal structure of the P450 BM3 heme domain mutant F87A in complex with N-imidazolyl-hexanoyl-L-phenylalanine and hydroxylamine

Summary for 7EGN

• Entry DOI: 10.2210/pdb7egn/pdb
• Descriptor: Bifunctional cytochrome P450/NADPH--P450 reductase, PROTOPORPHYRIN IX CONTAINING FE, (2S)-2-(6-imidazol-1-ylhexanoylamino)-3-phenyl-propanoic acid, ... (6 entities in total)
• Functional Keywords: dual-functional small molecule, p450 heme domain, complex, oxidoreductase
• Biological source: Bacillus megaterium (strain ATCC 14581 / DSM 32 / JCM 2506 / NBRC 15308 / NCIMB 9376 / NCTC 10342 / VKM B-512)
• Total number of polymer chains: 2
• Total formula weight: 108755.43

Authors

Jiang, Y.,Dong, S.,Feng, Y.,Cong, Z. (deposition date: 2021-03-24, release date: 2021-08-18, Last modification date: 2023-11-29)

• Primary citation: Zhang, X.,Jiang, Y.,Chen, Q.,Dong, S.,Feng, Y.,Cong, Z.,Shaik, S.,Wang, B.; H-Bonding Networks Dictate the Molecular Mechanism of H2O2 Activation by P450; Acs Catalysis, 11:8774-8785, 2021; DOI: 10.1021/acscatal.1c02068

Experimental method

X-RAY DIFFRACTION (2.7 Å)