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Structure paper

TitleEnsemble-function relationships to dissect mechanisms of enzyme catalysis.
Journal, issue, pagesSci Adv, Vol. 8, Page eabn7738-eabn7738, Year 2022
Publish dateAug 23, 2021 (structure data deposition date)
AuthorsYabukarski, F. / Doukov, T. / Pinney, M.M. / Biel, J.T. / Fraser, J.S. / Herschlag, D.
External linksSci Adv / PubMed:36240280
MethodsX-ray diffraction
Resolution1.1 - 1.16 Å
Structure data

PDB-7rxf:
Multi-conformer model of Apo Ketosteroid Isomerase Y57F mutant from Pseudomonas Putida (pKSI) at 250 K
Method: X-RAY DIFFRACTION / Resolution: 1.16 Å

PDB-7rxk:
Multi-conformer model of Apo Ketosteroid Isomerase Y32F/Y57F mutant from Pseudomonas Putida (pKSI) at 250 K
Method: X-RAY DIFFRACTION / Resolution: 1.1 Å

PDB-7ry4:
Multi-conformer model of Ketosteroid Isomerase Y57F/D40N mutant from Pseudomonas Putida (pKSI) bound to a transition state analog at 250 K
Method: X-RAY DIFFRACTION / Resolution: 1.11 Å

Chemicals

ChemComp-MG:
Unknown entry

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-J3Z:
(9beta,13alpha)-3-hydroxyestra-1,3,5(10)-trien-17-one / hormone*YM

Source
  • pseudomonas putida (bacteria)
KeywordsISOMERASE

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