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TitleStructure, Mutagenesis, and QM:MM Modeling of 3-Ketosteroid Delta 1 -Dehydrogenase from Sterolibacterium denitrificans ─The Role of a New Putative Membrane-Associated Domain and Proton-Relay System in Catalysis.
Journal, issue, pagesBiochemistry, Vol. 62, Page 808-823, Year 2023
Publish dateJul 1, 2021 (structure data deposition date)
AuthorsWojcik, P. / Glanowski, M. / Mrugala, B. / Procner, M. / Zastawny, O. / Flejszar, M. / Kurpiewska, K. / Niedzialkowska, E. / Minor, W. / Oszajca, M. ...Wojcik, P. / Glanowski, M. / Mrugala, B. / Procner, M. / Zastawny, O. / Flejszar, M. / Kurpiewska, K. / Niedzialkowska, E. / Minor, W. / Oszajca, M. / Bojarski, A.J. / Wojtkiewicz, A.M. / Szaleniec, M.
External linksBiochemistry / PubMed:36625854
MethodsX-ray diffraction
Resolution1.84 Å
Structure data

PDB-7p18:
Crystal structure of 3-ketosteroid delta1-dehydrogenase from Sterolibacterium denitrificans in complex with 1,4-androstadiene-3,17-dione
Method: X-RAY DIFFRACTION / Resolution: 1.84 Å

Chemicals

ChemComp-FAD:
FLAVIN-ADENINE DINUCLEOTIDE / FAD*YM

ChemComp-ANB:
ANDROSTA-1,4-DIENE-3,17-DIONE

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-GOL:
GLYCEROL

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER

Source
  • sterolibacterium denitrificans (bacteria)
KeywordsOXIDOREDUCTASE / Flavoprotein / Dehydrogenase / 3-Ketosteroid Delta1-dehydrogenase / 3-Ketosteroid Dehydrogenase / 3-Oxosteroid Dehydrogenase / Rossmann Fold

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