Inhibitors of the M2 Proton Channel Engage and Disrupt Transmembrane Networks of Hydrogen-Bonded Waters.
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DOI: 10.1021/jacs.8b06741
Abstract: Water-mediated interactions play key roles in drug binding. In protein sites with sparse polar functionality, a small-molecule approach is often viewed as insufficient to achieve high affinity and specificity. Here we show that small molecules… read more here.
Keywords: hydrogen bonded; proton channel; bound inwardclosed; networks hydrogen ... See more keywords