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TitleCrystal structures of Trypanosoma brucei sterol 14alpha-demethylase and implications for selective treatment of human infections.
Journal, issue, pagesJ. Biol. Chem., Vol. 285, Page 1773-1780, Year 2010
Publish dateJan 30, 2009 (structure data deposition date)
AuthorsLepesheva, G.I. / Park, H.W. / Hargrove, T.Y. / Vanhollebeke, B. / Wawrzak, Z. / Harp, J.M. / Sundaramoorthy, M. / Nes, W.D. / Pays, E. / Chaudhuri, M. ...Lepesheva, G.I. / Park, H.W. / Hargrove, T.Y. / Vanhollebeke, B. / Wawrzak, Z. / Harp, J.M. / Sundaramoorthy, M. / Nes, W.D. / Pays, E. / Chaudhuri, M. / Villalta, F. / Waterman, M.R.
External linksJ. Biol. Chem. / PubMed:19923211
MethodsX-ray diffraction
Resolution1.87 - 1.89 Å
Structure data

PDB-3g1q:
Crystal structure of sterol 14-alpha demethylase (CYP51) from Trypanosoma brucei in ligand free state
Method: X-RAY DIFFRACTION / Resolution: 1.89 Å

PDB-3gw9:
Crystal structure of sterol 14-alpha demethylase (CYP51) from Trypanosoma brucei bound to an inhibitor N-(1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl)-4-(5-phenyl-1,3,4-oxaziazol-2-yl)benzamide
Method: X-RAY DIFFRACTION / Resolution: 1.87 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-HOH:
WATER

ChemComp-VNI:
N-[(1R)-1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

Source
  • trypanosoma brucei (eukaryote)
KeywordsOXIDOREDUCTASE / sterol 14-alpha demethylase / CYP51 / cytochrome P450 / heme / monooxygenase / membrane protein / sterol biosynthesis / STEROL 14ALPHA-DEMETHYLASE / LIPIDS / ENDOPLASMIC RETICULUM / IRON / HEME-THIOLATE PROTEIN

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