Crystal structures of the kinase domain of AKT2 in complex with ATP-competitive inhibitors

Summary for 3E8D

Related3E87 3E88 3E8C 3E8E
DescriptorRAC-beta serine/threonine-protein kinase, Glycogen synthase kinase-3 beta peptide, 4-[2-(4-amino-2,5-dihydro-1,2,5-oxadiazol-3-yl)-6-{[(1S)-3-amino-1-phenylpropyl]oxy}-1-ethyl-1H-imidazo[4,5-c]pyridin-4-yl]-2-methylbut-3-yn-2-ol, ... (4 entities in total)
Functional Keywordsakt2, kinase, gsk3 beta, atp-binding, nucleotide-binding, phosphoprotein, serine/threonine-protein kinase, transferase, wnt signaling pathway
Biological sourceHomo sapiens (human)
Cellular locationCytoplasm P31751 P49841
Total number of polymer chains4
Total molecular weight81318.53
Concha, N.O.,Elkins, P.A.,Smallwood, A.,Ward, P. (deposition date: 2008-08-19, release date: 2008-10-14, Last modification date: 2017-10-25)
Primary citation
Rouse, M.B.,Seefeld, M.A.,Leber, J.D.,McNulty, K.C.,Sun, L.,Miller, W.H.,Zhang, S.,Minthorn, E.A.,Concha, N.O.,Choudhry, A.E.,Schaber, M.D.,Heerding, D.A.
Aminofurazans as potent inhibitors of AKT kinase
Bioorg.Med.Chem.Lett., 19:1508-1511, 2009
PubMed: 19179070 (PDB entries with the same primary citation)
DOI: 10.1016/j.bmcl.2009.01.002
MImport into Mendeley
Experimental method

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.27040.2%3.0%0MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
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PDB entries from 2020-09-16