2GU8

Discovery of 2-Pyrimidyl-5-Amidothiophenes as Novel and Potent Inhibitors for AKT: Synthesis and SAR Studies

Summary for 2GU8

• Entry DOI: 10.2210/pdb2gu8/pdb
• Descriptor: CAMP-dependent protein kinase, alpha-catalytic subunit, inhibitor of CAMP-dependent protein kinase, N-[(1S)-2-AMINO-1-(2,4-DICHLOROBENZYL)ETHYL]-5-[2-(METHYLAMINO)PYRIMIDIN-4-YL]THIOPHENE-2-CARBOXAMIDE, ... (4 entities in total)
• Functional Keywords: camp-dependent protein kinase, pka, akt, kinase, drug design, ternary complex, signaling protein, transferase-inhibitor complex, transferase/inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Cytoplasm (By similarity): P17612
• Total number of polymer chains: 2
• Total formula weight: 42076.76

Authors

Murray, J.M. (deposition date: 2006-04-28, release date: 2007-05-01, Last modification date: 2011-07-13)

• Primary citation: Lin, X.,Murray, J.M.,Rico, A.C.,Wang, M.X.,Chu, D.T.,Zhou, Y.,Del Rosario, M.,Kaufman, S.,Ma, S.,Fang, E.,Crawford, K.,Jefferson, A.B.; Discovery of 2-pyrimidyl-5-amidothiophenes as potent inhibitors for AKT: synthesis and SAR studies; Bioorg.Med.Chem.Lett., 16:4163-4168, 2006; PubMed: 16765046; DOI: 10.1016/j.bmcl.2006.05.092

Experimental method

X-RAY DIFFRACTION (2.2 Å)