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Use of (13)C(α) Chemical-Shifts in Protein Structure Determination

A physics-based method, aimed at determining protein structures by using NOE-derived distances together with observed and computed (13)C chemical shifts, is proposed. The approach makes use of (13)C(α) chemical shifts, computed at the density functional level of theory, to obtain torsional constrain...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Hauptverfasser: Vila, Jorge A., Ripoll, Daniel R., Scheraga, Harold A.
Format: Artigo
Sprache:Inglês
Veröffentlicht: 2007
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC2597024/
https://ncbi.nlm.nih.gov/pubmed/17516673
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp0683871
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