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Structure paper

TitleComparing and Combining Alternative Strategies for Enhancing Cytochrome P450 Peroxygenase Activity
Journal, issue, pagesAcs Catalysis, Vol. 15, Page 5191-5210, Year 2025
Publish dateOct 10, 2024 (structure data deposition date)
AuthorsPodgorski, M.N. / Bell, S.G.
External linksAcs Catalysis / Search PubMed
MethodsX-ray diffraction
Resolution1.52 - 2.5 Å
Structure data

PDB-9dwr:
The crystal structure of F182AQE CYP199A4 bound to 4-methoxybenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-9dx8:
The crystal structure of F182AQE CYP199A4 bound to 4-vinylbenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 1.679 Å

PDB-9dx9:
The crystal structure of F182AQE CYP199A4 bound to 4-t-butylbenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 1.52 Å

PDB-9dxw:
The crystal structure of F182A CYP199A4 bound to 4-t-butylbenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-9dy5:
The crystal structure of F182A CYP199A4 bound to 4-methylthiobenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

PDB-9dy9:
The crystal structure of F182A CYP199A4 bound to 4-methoxybenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 1.672 Å

PDB-9dyc:
The crystal structure of F182A CYP199A4 bound to 4-ethylbenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9dzr:
The crystal structure of F182AQE CYP199A4 bound to 4-methylthiobenzoic acid
Method: X-RAY DIFFRACTION / Resolution: 1.733 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-ANN:
4-METHOXYBENZOIC ACID

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-MW7:
4-ethenylbenzoic acid

ChemComp-ACT:
ACETATE ION

ChemComp-5R0:
4-~{tert}-butylbenzoic acid

ChemComp-MG:
Unknown entry

ChemComp-4MI:
4-methylsulfanylbenzoic acid

ChemComp-EGM:
4-ethylbenzoic acid

Source
  • rhodopseudomonas palustris haa2 (phototrophic)
KeywordsOXIDOREDUCTASE / Cytochrome P450 / peroxygenase mutant / Cytochrome P450 peroxygenase / epoxidation / hydroxylation / Cytochrome P450 peroxygenase mutant / sulfoxidation / O-demethylation

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