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TitleIs a Malleable Active Site Loop the Key to High Substrate Promiscuity? Hybrid, Biocatalytic Route to Structurally Diverse Taxoid Side Chains with Remarkable Dual Stereocontrol.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 64, Page e202510889-e202510889, Year 2025
Publish dateAug 16, 2024 (structure data deposition date)
AuthorsKudalkar, G.P. / Leidner, F. / Kumar, N. / Hass, J.L. / Madzelan, P. / Powell, D.R. / Day, V.W. / Magueres, P.L. / Ferrara, J.D. / Daniels, L.M. ...Kudalkar, G.P. / Leidner, F. / Kumar, N. / Hass, J.L. / Madzelan, P. / Powell, D.R. / Day, V.W. / Magueres, P.L. / Ferrara, J.D. / Daniels, L.M. / Yamano, A. / Ito, S. / Niu, W. / Grubmuller, H. / Wilson, M.A. / Berkowitz, D.B.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:40537411
MethodsX-ray diffraction
Resolution1.39 - 1.75 Å
Structure data

PDB-9d7j:
Clostridium acetobutylicum alcohol dehydrogenase bound to NADP+
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-9nyo:
Clostridium acetobutylicum alcohol dehydrogenase bound to NADP+, disordered nicotinamide
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

Chemicals

ChemComp-NAP:
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

Source
  • clostridium acetobutylicum (bacteria)
KeywordsOXIDOREDUCTASE / alcohol dehydrogenase / loop disorder / short chain alcohol dehydrogenase

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