4EJN
Crystal structure of autoinhibited form of AKT1 in complex with N-(4-(5-(3-acetamidophenyl)-2-(2-aminopyridin-3-yl)-3H-imidazo[4,5-b]pyridin-3-yl)benzyl)-3-fluorobenzamide
Summary for 4EJN
Entry DOI | 10.2210/pdb4ejn/pdb |
Descriptor | RAC-alpha serine/threonine-protein kinase, N-(4-{5-[3-(acetylamino)phenyl]-2-(2-aminopyridin-3-yl)-3H-imidazo[4,5-b]pyridin-3-yl}benzyl)-3-fluorobenzamide, 2-BUTANOL, ... (5 entities in total) |
Functional Keywords | akt1, autoinhibition, allosteric inhibitor, kinase inhibitor, hydrophobic collapase, kinase, atpase, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Cytoplasm: P31749 |
Total number of polymer chains | 1 |
Total formula weight | 52453.83 |
Authors | Eathiraj, S. (deposition date: 2012-04-06, release date: 2012-05-23, Last modification date: 2013-01-02) |
Primary citation | Ashwell, M.A.,Lapierre, J.M.,Brassard, C.,Bresciano, K.,Bull, C.,Cornell-Kennon, S.,Eathiraj, S.,France, D.S.,Hall, T.,Hill, J.,Kelleher, E.,Khanapurkar, S.,Kizer, D.,Koerner, S.,Link, J.,Liu, Y.,Makhija, S.,Moussa, M.,Namdev, N.,Nguyen, K.,Nicewonger, R.,Palma, R.,Szwaya, J.,Tandon, M.,Uppalapati, U.,Vensel, D.,Volak, L.P.,Volckova, E.,Westlund, N.,Wu, H.,Yang, R.Y.,Chan, T.C. Discovery and optimization of a series of 3-(3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amines: orally bioavailable, selective, and potent ATP-independent Akt inhibitors. J.Med.Chem., 55:5291-5310, 2012 Cited by PubMed: 22533986DOI: 10.1021/jm300276x PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.19 Å) |
Structure validation
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