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Structure paper

TitleThe Structure of Mycobacterium tuberculosis CYP125: molecular basis for cholesterol binding in a P450 needed for host infection.
Journal, issue, pagesJ. Biol. Chem., Vol. 284, Page 35524-35533, Year 2009
Publish dateSep 2, 2009 (structure data deposition date)
AuthorsMcLean, K.J. / Lafite, P. / Levy, C. / Cheesman, M.R. / Mast, N. / Pikuleva, I.A. / Leys, D. / Munro, A.W.
External linksJ. Biol. Chem. / PubMed:19846552
MethodsX-ray diffraction
Resolution1.352 - 2.19 Å
Structure data

PDB-3ivy:
Crystal structure of Mycobacterium tuberculosis cytochrome P450 CYP125, p212121 crystal form
Method: X-RAY DIFFRACTION / Resolution: 1.352 Å

PDB-3iw0:
Crystal structure of Mycobacterium tuberculosis cytochrome P450 CYP125, C2221 crystal form
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

PDB-3iw1:
Crystal structure of Mycobacterium tuberculosis cytochrome P450 CYP125 in complex with androstenedione
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-3iw2:
Crystal structure of Mycobacterium tuberculosis cytochrome P450 CYP125 in complex with econazole
Method: X-RAY DIFFRACTION / Resolution: 2.19 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-HOH:
WATER

ChemComp-PO4:
PHOSPHATE ION

ChemComp-ASD:
4-ANDROSTENE-3-17-DIONE

ChemComp-EKO:
4-[(2R)-2-[(4-chlorobenzyl)oxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole

Source
  • mycobacterium tuberculosis (bacteria)
KeywordsOXIDOREDUCTASE / cholesterol / cytochrome P450 / tuberculosis / monooxygenase / Heme / Iron / Metal-binding / androstenedione / monoxygenase / econazole

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