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Stabilizing Role of Water Solvation on Anion−π Interactions in Proteins

[Image: see text] In this work, anion−π interactions between sulfate groups (SO(4)(2–)) and protein aromatic amino acids (AAs) (histidine protonated (HisP), histidine neutral (HisN), tyrosine (Tyr), tryptophan (Trp), and phenylalanine (Phe)) in an aqueous environment have been analyzed using quantum...

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Detalles Bibliográficos
Autores principales: Balamurugan, Kanagasabai, Pisabarro, M. Teresa
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8495695/
https://www.ncbi.nlm.nih.gov/pubmed/34632193
http://dx.doi.org/10.1021/acsomega.1c03264