Cavity Versus Ligand Shape Descriptors: Application to Urokinase Binding Pockets

We analyzed 78 binding pockets of the human urokinase plasminogen activator (uPA) catalytic domain extracted from a data set of crystallized uPA–ligand complexes. These binding pockets were computed with an original geometric method that does NOT involve any arbitrary parameter, such as cutoff dista...

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Dades bibliogràfiques
Publicat a:J Comput Biol
Autors principals: Cerisier, Natacha, Regad, Leslie, Triki, Dhoha, Camproux, Anne-Claude, Petitjean, Michel
Format: Artigo
Idioma:Inglês
Publicat: Mary Ann Liebert, Inc. 2017
Matèries:
Research Articles
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC5684670/
https://ncbi.nlm.nih.gov/pubmed/28570103
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1089/cmb.2017.0061
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