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Membrane Environment Modulates the pK(a) Values of Transmembrane Helices

[Image: see text] In this work, we apply the recently developed constant pH molecular dynamics technique to study protonation equilibria of titratable side chains in the context of simple transmembrane (TM) helices and explore the effect of pH on their configurations in membrane bilayers. We observe...

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Bibliografiske detaljer
Udgivet i:J Phys Chem B
Main Authors: Panahi, Afra, Brooks, Charles L.
Format: Artigo
Sprog:Inglês
Udgivet: American Chemical Society 2015
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC4404502/
https://ncbi.nlm.nih.gov/pubmed/25734901
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.5b00289
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