A Simple PB/LIE Free Energy Function Accurately Predicts the Peptide Binding Specificity of the Tiam1 PDZ Domain

PDZ domains generally bind short amino acid sequences at the C-terminus of target proteins, and short peptides can be used as inhibitors or model ligands. Here, we used experimental binding assays and molecular dynamics simulations to characterize 51 complexes involving the Tiam1 PDZ domain and to t...

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Detalles Bibliográficos
Autores principales: Panel, Nicolas, Sun, Young Joo, Fuentes, Ernesto J., Simonson, Thomas
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2017
Materias:
Molecular Biosciences
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5623046/
https://www.ncbi.nlm.nih.gov/pubmed/29018806
http://dx.doi.org/10.3389/fmolb.2017.00065

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5623046/
https://www.ncbi.nlm.nih.gov/pubmed/29018806
http://dx.doi.org/10.3389/fmolb.2017.00065

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