KRAS(G12C)–AMG 510 interaction dynamics revealed by all-atom molecular dynamics simulations

Abstract The first KRAS(G12C) targeting inhibitor in clinical development, AMG 510, has shown promising antitumor activity in clinical trials. On the molecular level, however, the interaction dynamics of this covalently bound drug–protein complex has been undetermined. Here, we disclose the interact...

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Bibliographic Details
Main Author: Tatu Pantsar
Format: Article
Language:English
Published: Nature Publishing Group 2020-07-01
Series:Scientific Reports
Online Access:https://doi.org/10.1038/s41598-020-68950-y