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TitleBiocatalytic Baeyer-Villiger Reactions: Uncovering the Source of Regioselectivity at Each Evolutionary Stage of a Mutant with Scrutiny of Fleeting Chiral Intermediates.
Journal, issue, pagesAcs Catalysis, Vol. 12, Page 3669-3680, Year 2022
Publish dateAug 23, 2021 (structure data deposition date)
AuthorsDong, Y.J. / Li, T. / Zhang, S.Q. / Sanchis, J. / Yin, H. / Ren, J. / Sheng, X. / Li, G.Y. / Reetz, M.T.
External linksAcs Catalysis / Search PubMed
MethodsX-ray diffraction
Resolution1.764 - 2.72 Å
Structure data

PDB-7v8o:
Crystal structure of cyclohexanone monooxygenase from T. municipale mutant L437T complexed with NADP+ and FAD in space group of P21221
Method: X-RAY DIFFRACTION / Resolution: 2.72 Å

PDB-7v8r:
Crystal structure of cyclohexanone monooxygenase from T. municipale mutant L437T complexed with NADP+ and FAD in space group of C2221
Method: X-RAY DIFFRACTION / Resolution: 1.764 Å

PDB-7v8s:
Crystal structure of cyclohexanone monooxygenase from T. municipale mutant L437T complexed with NADP+ and FAD in space group of P1211
Method: X-RAY DIFFRACTION / Resolution: 2.08 Å

Chemicals

ChemComp-FAD:
FLAVIN-ADENINE DINUCLEOTIDE / FAD*YM

ChemComp-NAP:
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-GOL:
GLYCEROL

Source
  • thermocrispum municipale (bacteria)
KeywordsFLAVOPROTEIN / cyclohexanone monooxygenase / directed evolution / regioselectivity

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