Automating crystallographic structure solution and refinement of protein–ligand complexes

High-throughput drug-discovery and mechanistic studies often require the determination of multiple related crystal structures that only differ in the bound ligands, point mutations in the protein sequence and minor conformational changes. If performed manually, solution and refinement requires exten...

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Detalles Bibliográficos
Autores principales: Echols, Nathaniel, Moriarty, Nigel W., Klei, Herbert E., Afonine, Pavel V., Bunkóczi, Gábor, Headd, Jeffrey J., McCoy, Airlie J., Oeffner, Robert D., Read, Randy J., Terwilliger, Thomas C., Adams, Paul D.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Research Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3919266/
https://www.ncbi.nlm.nih.gov/pubmed/24419387
http://dx.doi.org/10.1107/S139900471302748X

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3919266/
https://www.ncbi.nlm.nih.gov/pubmed/24419387
http://dx.doi.org/10.1107/S139900471302748X

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