Article ID Journal Published Year Pages File Type
5385155 Chemical Physics Letters 2011 6 Pages PDF
Abstract
► Significant charge delocalization for bound Cl− ions in ClC Cl− transport proteins. ► Important sinks of charges: Cl− solvation shells and the gating residue E148. ► Extensive anion-pi charge transfer found along the translocation path. ► An additional binding site for Cl− suggested by DFT geometry optimizations.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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