Crystallization (Comment) | Organism |
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dispersion-corrected density functional theoretical calculations. The hydrogen bond effect of a water molecule within the active site lowers the energy barrier significantly. The adjacent hydrogen bond between the hydroxyl group of the substrate and the oxo group of compound I in the second hydroxylation affects the H-abstraction significantly and also affects the transition state by bending the alignment of the C-H-O moiety. The reactions proceed via a typical two-state reactivity mechanism | synthetic construct |
Organism | UniProt | Comment | Textmining |
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synthetic construct | - |
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