Enhanced electron-density envelopes by extended solvent definition
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Updated: Oct 28, 2026

Unraveling Entropic Rate Acceleration Induced by Solvent Dynamics in Membrane Enzymes
Published on: January 16, 2016
1Département de biochemie, Université de Montréal, CP 6128 Station Centre Ville, Montréal, Canada H3C 3J7. nick@bch.umontreal.ca
Abstract:
Extended delineation of water molecules, monitored using Rfree values, afforded considerable improvement in quality of electron-density maps for structure determination of mammalian class I and E. coli class II aldolases. Augmented solvent definition results in an additional decrease in Rfree values of 3-4% and is reflected in significantly enhanced electron-density envelopes enabling tracing of amino-acid sequences through regions of otherwise discontinuous or weak electron density.
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