Loop dynamics behind the affinity of DARPins towards ERK2: Molecular dynamics simulations (MDs) and elastic network model (ENM)

The binding affinity and dynamics profiles of non-phosphorylated extracellular regulated kinase 2 (ERK2), in complex with DARPins (designed ankyrin repeat proteins) as a phosphorylation inhibitor, has been investigated using molecular dynamics simulations (MDs) and elastic network model (ENM). The s...

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Bibliographic Details

Main Authors:	Gautam, Vertika, Chong, Wei Lim, Chin, Sek Peng, Zain, Sharifuddin Md, Abd Rahman, Noorsaadah, Vao-soongnern, Visit, Lee, Vannajan Sanghiran
Format:	Article
Published:	Elsevier 2019
Subjects:	Q Science (General) QD Chemistry
Online Access:	http://eprints.um.edu.my/20084/ https://doi.org/10.1016/j.molliq.2018.10.157
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