Solution NMR Refinement of a Metal Ion Bound Protein Using Metal Ion Inclusive Restrained Molecular Dynamics Methods

Correctly calculating the structure of metal coordination sites in a protein during the process of nuclear magnetic resonance (NMR) structure determination and refinement continues to be a challenging task. In this study, we present an accurate and convenient means by which to include metal ions in...

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Bibliographic Details
Main Authors: Chakravorty, Dhruva K., Wang, Bing, Lee, Chul Won, Guerra, Alfredo J., Giedroc, David P., Merz, Kenneth M.
Format: Artigo
Language:Inglês
Published: 2013
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Article
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC3773525/
https://ncbi.nlm.nih.gov/pubmed/23609042
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10858-013-9729-7
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