Structural Diversity and Changes in Conformational Equilibria of Biantennary Complex-Type N-Glycans in Water Revealed by Replica-Exchange Molecular Dynamics Simulation

Structural diversity of N-glycans is essential for specific binding to their receptor proteins. To gain insights into structural and dynamic aspects in atomic detail not normally accessible by experiment, we here perform extensive molecular-dynamics simulations of N-glycans in solution using the rep...

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Detalles Bibliográficos
Main Authors: Re, Suyong, Miyashita, Naoyuki, Yamaguchi, Yoshiki, Sugita, Yuji
Formato: Artigo
Idioma:Inglês
Publicado: The Biophysical Society 2011
Assuntos:
Biophysical Letter
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC3218325/
https://ncbi.nlm.nih.gov/pubmed/22098756
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2011.10.019
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