Intermolecular Interactions of Nucleoside Antibiotic Tunicamycin with On-Target MraY(CB)-TUN and Off-Target DPAGT1-TUN in the Active Sites Delineated by Quantum Mechanics/Molecular Mechanics Calculations

[Image: see text] Tunicamycin (TUN) is a nucleoside antibiotic with a complex structure comprising uracil, tunicamine sugar, N-acetylglucosamine (GlcNAc), and fatty acyl tail moieties. TUN, known as a canonical inhibitor, blocks vital functions of certain transmembrane protein families, for example,...

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Autores principales: Astani, Elahe K., Malek Zadeh, Saeid, Hsu, Ning-Shian, Lin, Kuan-Hung, Sardari, Soroush, Li, Tsung-Lin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9494639/
https://www.ncbi.nlm.nih.gov/pubmed/36157785
http://dx.doi.org/10.1021/acsomega.2c02213

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