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Structure paper

TitleStructural basis of steroid binding and oxidation by the cytochrome P450 CYP109E1 from Bacillus megaterium.
Journal, issue, pagesFebs J., Vol. 283, Page 4128-4148, Year 2016
Publish dateJun 9, 2016 (structure data deposition date)
AuthorsJozwik, I.K. / Kiss, F.M. / Abdulmughni, A. / Brill, E. / Zapp, J. / Pleiss, J. / Bernhardt, R. / Thunnissen, A.W.
External linksFebs J. / PubMed:27686671
MethodsX-ray diffraction
Resolution2.1 - 2.55 Å
Structure data

PDB-5l90:
The crystal structure of substrate-free CYP109E1 from Bacillus megaterium at 2.55 Angstrom resolution
Method: X-RAY DIFFRACTION / Resolution: 2.55 Å

PDB-5l91:
The 2.2 A crystal structure of CYP109E1 from Bacillus megaterium bound with four corticosterone molecules
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-5l92:
The 2.1 A crystal structure of CYP109E1 from Bacillus megaterium in complex with corticosterone
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-5l94:
The 2.25 A crystal structure of CYP109E1 from Bacillus megaterium in complex with testosterone
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE / Heme B

ChemComp-HOH:
WATER / Water

ChemComp-C0R:
CORTICOSTERONE / hormone*YM / Corticosterone

ChemComp-MLA:
MALONIC ACID / Malonic acid

ChemComp-TES:
TESTOSTERONE / hormone*YM / Testosterone

Source
  • bacillus megaterium (strain dsm 319) (bacteria)
KeywordsOXIDOREDUCTASE / Bacillus / Bacterial Proteins / Binding Sites / Catalysis / Cytochrome P-450 Enzyme System / Cytochrome P450 / Hydroxylation / Escherichia coli / Heme / Ligands / Molecular Structure / Oxidation-Reduction / Oxygen / Protein / Protein Structure / Secondary / Steroids / Substrate Specificity / Corticosterone / Testosterone

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