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Patterns in Protein Flexibility: A Comparison of NMR “Ensembles”, MD Trajectories, and Crystallographic B-Factors

Proteins are molecular machines requiring flexibility to function. Crystallographic B-factors and Molecular Dynamics (MD) simulations both provide insights into protein flexibility on an atomic scale. Nuclear Magnetic Resonance (NMR) lacks a universally accepted analog of the B-factor. However, a la...

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Bibliografiske detaljer
Udgivet i:Molecules
Main Authors: Reinknecht, Christopher, Riga, Anthony, Rivera, Jasmin, Snyder, David A.
Format: Artigo
Sprog:Inglês
Udgivet: MDPI 2021
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7967184/
https://ncbi.nlm.nih.gov/pubmed/33803249
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26051484
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