4GV1

PKB alpha in complex with AZD5363

Summary for 4GV1

DescriptorRAC-alpha serine/threonine-protein kinase, 4-amino-N-[(1S)-1-(4-chlorophenyl)-3-hydroxypropyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide, GLYCEROL, ... (4 entities in total)
Functional Keywordsprotein kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological sourceHomo sapiens (human)
Cellular locationCytoplasm P31749
Total number of polymer chains1
Total molecular weight40191.15
Authors
Primary citation
Addie, M.,Ballard, P.,Buttar, D.,Crafter, C.,Currie, G.,Davies, B.R.,Debreczeni, J.,Dry, H.,Dudley, P.,Greenwood, R.,Johnson, P.D.,Kettle, J.G.,Lane, C.,Lamont, G.,Leach, A.,Luke, R.W.,Morris, J.,Ogilvie, D.,Page, K.,Pass, M.,Pearson, S.,Ruston, L.
Discovery of 4-Amino-N-[(1S)-1-(4-chlorophenyl)-3-hydroxypropyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide (AZD5363), an Orally Bioavailable, Potent Inhibitor of Akt Kinases.
J.Med.Chem., 56:2059-2073, 2013
PubMed: 23394218 (PDB entries with the same primary citation)
DOI: 10.1021/jm301762v
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.49 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.223201.4%0.6%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 4gv1
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Molmil generated image of 4gv1
rotated about x axis by 90°
Molmil generated image of 4gv1
rotated about y axis by 90°