Free Energy Profiles Relating With Conformational Transition of the Switch Domains Induced by G12 Mutations in GTP-Bound KRAS

Mutations of G12 in KRAS have been involved in different cancers. Multiple replica-Gaussian accelerated molecular dynamics (MR-GaMD) simulations are applied to investigate conformational changes of the switch domains caused by G12C, G12D and G12R. Free energy landscapes suggest that G12C, G12D and G...

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Detalles Bibliográficos
Autores principales: Chen, Jianzhong, Zhang, Shaolong, Zeng, Qingkai, Wang, Wei, Zhang, Qinggang, Liu, Xinguo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2022
Materias:
Molecular Biosciences
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9108337/
https://www.ncbi.nlm.nih.gov/pubmed/35586192
http://dx.doi.org/10.3389/fmolb.2022.912518

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9108337/
https://www.ncbi.nlm.nih.gov/pubmed/35586192
http://dx.doi.org/10.3389/fmolb.2022.912518

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