2qd9

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2qd9, resolution 1.70Å

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P38 Alpha Map Kinase inhibitor based on heterobicyclic scaffolds

Overview

The synthesis and structure-activity relationships (SAR) of p38alpha MAP, kinase inhibitors based on heterobicyclic scaffolds are described. This, effort led to the identification of compound (21) as a potent inhibitor of, p38alpha MAP kinase with good cellular potency toward the inhibition of, TNF-alpha production. X-ray co-crystallography of an oxalamide analog (24), bound to unphosphorylated p38alpha is also disclosed.

About this Structure

2QD9 is a Single protein structure of sequence from Homo sapiens with LGF as ligand. Active as Mitogen-activated protein kinase, with EC number 2.7.11.24 Full crystallographic information is available from OCA.

Reference

Synthesis and SAR of p38alpha MAP kinase inhibitors based on heterobicyclic scaffolds., Murali Dhar TG, Wrobleski ST, Lin S, Furch JA, Nirschl DS, Fan Y, Todderud G, Pitt S, Doweyko AM, Sack JS, Mathur A, McKinnon M, Barrish JC, Dodd JH, Schieven GL, Leftheris K, Bioorg Med Chem Lett. 2007 Jul 21;. PMID:17664068

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