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TitleEngineering Cytochrome P450BM3 Enzymes for Direct Nitration of Unsaturated Hydrocarbons.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 62, Page e202217678-e202217678, Year 2023
Publish dateDec 21, 2021 (structure data deposition date)
AuthorsWang, X. / Lin, X. / Jiang, Y. / Qin, X. / Ma, N. / Yao, F. / Dong, S. / Liu, C. / Feng, Y. / Jin, L. ...Wang, X. / Lin, X. / Jiang, Y. / Qin, X. / Ma, N. / Yao, F. / Dong, S. / Liu, C. / Feng, Y. / Jin, L. / Xian, M. / Cong, Z.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:36660956
MethodsX-ray diffraction
Resolution1.68 - 2.07 Å
Structure data

PDB-7wdg:
Crystal structure of the P450 BM3 heme domain mutant F87L in complex with N-imidazolyl-hexanoyl-L-phenylalanine, phenol and hydroxylamine
Method: X-RAY DIFFRACTION / Resolution: 2.07 Å

PDB-7wdh:
Crystal structure of the P450 BM3 heme domain mutant F87A in complex with N-imidazolyl-hexanoyl-L-phenylalanine, phenol and hydroxylamine
Method: X-RAY DIFFRACTION / Resolution: 1.68 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-HOA:
HYDROXYAMINE

ChemComp-IPH:
PHENOL

ChemComp-IC6:
(2S)-2-(6-imidazol-1-ylhexanoylamino)-3-phenyl-propanoic acid

ChemComp-HOH:
WATER

Source
  • priestia megaterium (bacteria)
KeywordsOXIDOREDUCTASE / Dual-functional small molecule / P450 heme domain / Complex

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