Robust Identification of Binding Hot Spots Using Continuum Electrostatics: Application to Hen Egg-White Lysozyme

[Image: see text] Binding hot spots, protein regions with high binding affinity, can be identified by using X-ray crystallography or NMR spectroscopy to screen libraries of small organic molecules that tend to cluster at such hot spots. FTMap, a direct computational analogue of the experimental scre...

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Detalles Bibliográficos
Autores principales: Hall, David H., Grove, Laurie E., Yueh, Christine, Ngan, Chi Ho, Kozakov, Dima, Vajda, Sandor
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2011
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3244821/
https://www.ncbi.nlm.nih.gov/pubmed/22092261
http://dx.doi.org/10.1021/ja207914y

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3244821/
https://www.ncbi.nlm.nih.gov/pubmed/22092261
http://dx.doi.org/10.1021/ja207914y

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