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Accurate Backbone (13)C and (15)N Chemical Shift Tensors in Galectin-3 by MAS NMR and QM/MM: Details of Structure and Environment Matter

Chemical shift tensors obtained from solid-state NMR spectroscopy are very sensitive reporters of structure and dynamics in proteins. While accurate (13)C and (15)N chemical shift tensors are accessible by magic angle spinning (MAS) NMR, their quantum mechanical calculations remain challenging, part...

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Detalhes bibliográficos
Publicado no:Chemphyschem
Main Authors: Kraus, Jodi, Gupta, Rupal, Lu, Manman, Gronenborn, Angela M., Akke, Mikael, Polenova, Tatyana
Formato: Artigo
Idioma:Inglês
Publicado em: 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8080305/
https://ncbi.nlm.nih.gov/pubmed/32363727
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/cphc.202000249
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