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Structure-Affinity Properties of a High-Affinity Ligand of FKBP12 Studied by Molecular Simulations of a Binding Intermediate

With a view to explaining the structure-affinity properties of the ligands of the protein FKBP12, we characterized a binding intermediate state between this protein and a high-affinity ligand. Indeed, the nature and extent of the intermolecular contacts developed in such a species may play a role on...

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Detalhes bibliográficos
Publicado no:PLoS One
Main Authors: Olivieri, Lilian, Gardebien, Fabrice
Formato: Artigo
Idioma:Inglês
Publicado em: Public Library of Science 2014
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4264844/
https://ncbi.nlm.nih.gov/pubmed/25502559
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1371/journal.pone.0114610
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