H6H_hydroxylation_QMMM
CC-BY-4.0
The original dataset source can be reviewed here
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-4-19
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-4-19
This dataset derived results are published in:
Manuscript title: Regioselectivity of hyoscyamine 6β-hydroxylase-catalysed hydroxylation as revealed by high-resolution structural information and QM/MM calculations
DOI: 10.1039/d0dt00302f
View as
- ROOT
- LackingHydrogenBond
- extendedQM