Article ID Journal Published Year Pages File Type
6877782 Journal of Molecular Graphics and Modelling 2013 31 Pages PDF
Abstract
Isoleucine-release pathway from GAF domain in N-CodY is studied by using conventional MD, ED analysis and FPMD simulations. The detail releasing pathway is observed, and the conformational changes during isoleucine release are consistent with the experimental results. These results give useful information for isoleucine entering mechanism to the cavity.
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Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Molecular dynamics simulations of isoleucine-release pathway in GAF domain of N-CodY from Bacillus Subtilis
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