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Computational Studies of Gramicidin Permeation: An Entryway Sulfonate Enhances Cation Occupancy at Entry Sites
The impact on the cation-transport free-energy profile of replacing the C-terminal ethanolamine in the gramicidin A channel with a taurine residue is studied using molecular dynamics simulations of gramicidin A (1JNO) embedded in a lipid bilayer (DMPC) with 1 mol/kg NaCl saline solution. The potenti...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2009
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2701196/ https://ncbi.nlm.nih.gov/pubmed/19361485 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bbamem.2009.03.021 |
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