Data on the mode of binding between avenanthramides and IKKβ domains in a docking model

Publication date: Available online 6 February 2018
Source:Data in Brief
Author(s): Chounghun Kang, Woo Shik Shin, Dongwook Yeo, Wonchung Lim, Li Li Ji
The data presented in this article are related to the research paper entitled "Anti-inflammatory effect of avenanthramides via NF-κB pathways in C2C12 skeletal muscle cells." [1] This article includes experimental procedures used to analyze the mode of binding between and IkB kinase (IKKβ) and avenanthramides which are a group of phenolic alkaloids found in oats. The protein-ligand docking and the computer simulation method of molecular dynamics (MD) for studying the physical interactions of molecules were performed.



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