PDBsum entry 2o5k

Transferase

PDB id: 2o5k

Contents

Protein chain

350 a.a.

Ligands

HBM

References listed in PDB file

Key reference

• Title: Design and synthesis of 7-Hydroxy-1h-Benzoimidazole derivatives as novel inhibitors of glycogen synthase kinase-3beta.
• Authors: D.Shin, S.C.Lee, Y.S.Heo, W.Y.Lee, Y.S.Cho, Y.E.Kim, Y.L.Hyun, J.M.Cho, Y.S.Lee, S.Ro.
• Ref.: Bioorg Med Chem Lett, 2007, 17, 5686-5689. [DOI no: 10.1016/j.bmcl.2007.07.056]
• PubMed id: 17764934

Abstract

A hydroxy functional group was introduced as the hydrogen bond donor and acceptor at the hinge region of protein kinase in order to develop novel ATP-competitive inhibitors. Several derivatives of 7-hydroxyl-1H-benzoimidazole were designed as inhibitors of glycogen synthase kinase-3beta with the help of ab initio calculations and a docking study. Enzymatic assay and an X-ray complex study showed that these designed compounds were highly potent ATP-competitive inhibitors.