Relative affinities of protein-cholesterol interactions from equilibrium molecular dynamics simulations

Specific interactions of lipids with membrane proteins contribute to protein stability and function. Multiple lipid interactions surrounding a membrane protein are often identified in molecular dynamics (MD) simulations and are, increasingly, resolved in cryo-electron microscopy (cryo-EM) densities....

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Bibliographic Details
Main Authors: Ansell, TB, Curran, L, Horrell, MR, Pipatpolkai, T, Letham, SC, Song, W, Siebold, C, Stansfeld, PJ, Sansom, MSP, Corey, RA
Format: Journal article
Language:English
Published: American Chemical Society 2021