Determination of Accurate Backbone Chemical Shift Tensors in Microcrystalline Proteins by Integrating MAS NMR and QM/MM

Chemical shifts are highly sensitive probes of local conformation and overall structure. Both isotropic shifts and chemical shift tensors are readily accessible from NMR experiments but their quantum mechanical calculations remain challenging. In this work, we report and compare accurately measured...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Veröffentlicht in:Phys Chem Chem Phys
Hauptverfasser: Fritz, Matthew, Quinn, Caitlin M., Wang, Mingzhang, Hou, Guangjin, Lu, Xingyu, Koharudin, Leonardus M. I., Struppe, Jochem, Case, David A., Polenova, Tatyana, Gronenborn, Angela M.
Format: Artigo
Sprache:Inglês
Veröffentlicht: 2018
Schlagworte:
Article
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5892194/
https://ncbi.nlm.nih.gov/pubmed/29577158
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c8cp00647d
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!

Ähnliche Einträge