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Pressure Effects on the Ensemble Dynamics of Ubiquitin Inspected with Molecular Dynamics Simulations and Isotropic Reorientational Eigenmode Dynamics

According to NMR chemical shift data, the ensemble of ubiquitin is a mixture of “open” and “closed” conformations at rapid equilibrium. Pressure perturbations provide the means to study the transition between the two conformers by imposing an additional constraint on the system's partial molar...

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Detalhes bibliográficos
Main Authors: Sgourakis, Nikolaos G., Day, Ryan, McCallum, Scott A., Garcia, Angel E.
Formato: Artigo
Idioma:Inglês
Publicado em: The Biophysical Society 2008
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2553108/
https://ncbi.nlm.nih.gov/pubmed/18621814
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.108.133702
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