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Peptide Binding to a PDZ Domain by Electrostatic Steering via Nonnative Salt Bridges
We have captured the binding of a peptide to a PDZ domain by unbiased molecular dynamics simulations. Analysis of the trajectories reveals on-pathway encounter complex formation, which is driven by electrostatic interactions between negatively charged carboxylate groups in the peptide and positively...
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| Publicado en: | Biophys J |
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| Main Authors: | , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
The Biophysical Society
2015
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4423040/ https://ncbi.nlm.nih.gov/pubmed/25954893 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2015.03.038 |
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