Oxygen binding isotope effects of triazole-based HIV-1 reverse transcriptase inhibitors indicate the actual binding site.
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DOI: 10.1016/j.abb.2017.10.017
Abstract: Binding isotope effects (BIEs) associated with binding of four triazole-based ligands to HIV-1 reverse transcriptase have been calculated at the QM/MM MD level of theory. Two main binding sites: allosteric cavity and RNase H active… read more here.
Keywords: hiv reverse; binding isotope; isotope; isotope effects ... See more keywords