Investigation of CAS multifuntionality and selectivity: hydroxylation of deoxyguanidinoproclavaminate (DGPC), desaturation of dihydroclavaminate (DHC) and desaturation/hydroxylation of deoxyproclavaminate (DPC).

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Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-4-25

This dataset derived results are published in:

Manuscript title: Enzyme multifunctionality via control of substrate positioning within the catalytic cycle ‐ a QM/MM study for clavaminic acid synthase

Journal: Chem. Eur. J.

DOI: 10.1002/chem.202004426