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Dipole Moment and Binding Energy of Water in Proteins from Crystallographic Analysis

[Image: see text] The energetics of water molecules in proteins is studied using the water placement software Dowser. We compared the water position predictions for 14 high-resolution crystal structures of oligopeptide-binding protein (OppA) containing a large number of resolved internal water molec...

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Detalhes bibliográficos
Main Authors: Morozenko, A., Leontyev, I. V., Stuchebrukhov, A. A.
Formato: Artigo
Idioma:Inglês
Publicado em: American Chemical Society 2014
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4196742/
https://ncbi.nlm.nih.gov/pubmed/25328496
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct500358r
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