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3P79

P38 inhibitor-bound

Summary for 3P79
Entry DOI10.2210/pdb3p79/pdb
Related3P78 3P7A 3P7B 3P7C
DescriptorMitogen-activated protein kinase 14, octyl beta-D-glucopyranoside, 1-{3-tert-butyl-1-[2-(1,1-dioxidothiomorpholin-4-yl)-2-oxoethyl]-1H-pyrazol-5-yl}-3-naphthalen-2-ylurea, ... (4 entities in total)
Functional Keywordskinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological sourceMus musculus (mouse)
Total number of polymer chains1
Total formula weight42875.92
Authors
Moffett, K.K.,Namboodiri, H. (deposition date: 2010-10-12, release date: 2011-10-12, Last modification date: 2024-02-21)
Primary citationMoffett, K.,Konteatis, Z.,Nguyen, D.,Shetty, R.,Ludington, J.,Fujimoto, T.,Lee, K.J.,Chai, X.,Namboodiri, H.,Karpusas, M.,Dorsey, B.,Guarnieri, F.,Bukhtiyarova, M.,Springman, E.,Michelotti, E.
Discovery of a novel class of non-ATP site DFG-out state p38 inhibitors utilizing computationally assisted virtual fragment-based drug design (vFBDD).
Bioorg.Med.Chem.Lett., 21:7155-7165, 2011
Cited by
PubMed: 22014550
DOI: 10.1016/j.bmcl.2011.09.078
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.1 Å)
Structure validation

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