E484K mutation in SARS-CoV-2 RBD enhances binding affinity with hACE2 but reduces interactions with neutralizing antibodies and nanobodies: Binding free energy calculation studies
Wei Bu Wang, Yu Liang, Yu Qin Jin, Jing Zhang, Ji Guo Su, Qi Ming Li
This study investigates how the E484K mutation in SARS-CoV-2 RBD affects binding to hACE2 and neutralizing antibodies using molecular dynamics simulations.
Journal of Molecular Graphics and Modelling · Sep 17, 2021Peer-reviewedBioinformatics