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Importance of protein flexibility in ranking ERK2 Type I(1/2) inhibitor affinities: a computational study

Extracellular-regulated kinase (ERK2) has been regarded as an essential target for various cancers, especially melanoma. Recently, pyrrolidine piperidine derivatives were reported as Type I(1/2) inhibitors of ERK2, which occupy both the ATP binding pocket and the allosteric pocket. Due to the dynami...

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Detalles Bibliográficos
Autores principales: Niu, Yuzhen, Yao, Xiaojun, Ji, Hongfang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9063686/
https://www.ncbi.nlm.nih.gov/pubmed/35515820
http://dx.doi.org/10.1039/c9ra01657k