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TitleRegio- and Stereoselective Steroid Hydroxylation at C7 by Cytochrome P450 Monooxygenase Mutants.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 59, Page 12499-12505, Year 2020
Publish dateFeb 13, 2020 (structure data deposition date)
AuthorsLi, A. / Acevedo-Rocha, C.G. / D'Amore, L. / Chen, J. / Peng, Y. / Garcia-Borras, M. / Gao, C. / Zhu, J. / Rickerby, H. / Osuna, S. ...Li, A. / Acevedo-Rocha, C.G. / D'Amore, L. / Chen, J. / Peng, Y. / Garcia-Borras, M. / Gao, C. / Zhu, J. / Rickerby, H. / Osuna, S. / Zhou, J. / Reetz, M.T.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:32243054
MethodsX-ray diffraction
Resolution1.68 Å
Structure data

PDB-6ly4:
The crystal structure of the BM3 mutant LG-23 in complex with testosterone
Method: X-RAY DIFFRACTION / Resolution: 1.68 Å

Chemicals

ChemComp-TES:
TESTOSTERONE

ChemComp-IMD:
IMIDAZOLE

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-HOH:
WATER

Source
  • bacillus megaterium (strain atcc 14581 / dsm 32 / jcm 2506 / nbrc 15308 / ncimb 9376 / nctc 10342 / vkm b-512) (bacteria)
KeywordsOXIDOREDUCTASE / P450-BM3 mutant / regio- and stereoselectivity / hydroxylation / testosterone

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