5A83

Crystal structure of human ATAD2 bromodomain in complex with 4-((3R, 4R)-4-3-methyl-5-(5-methylpyridin-3-yl)-2-oxo-1,2-dihydroquinolin-8- yl-aminopiperidin-3-yloxymethyl)-1-thiane-1,1-dione

Summary for 5A83

• Entry DOI: 10.2210/pdb5a83/pdb
• Related: 5A81 5A82 5A85
• Descriptor: ATPASE FAMILY AAA DOMAIN-CONTAINING PROTEIN 2, 1,2-ETHANEDIOL, 8-[[(3R,4R)-3-[[1,1-bis(oxidanylidene)thian-4-yl]methoxy]piperidin-4-yl]amino]-3-methyl-5-(5-methylpyridin-3-yl)-1H-quinolin-2-one, ... (5 entities in total)
• Functional Keywords: hydrolase, inhibitor, atad2, bromodomain, epigenetics, atpase family aaa domain-containing protein 2
• Biological source: HOMO SAPIENS (HUMAN)
• Total number of polymer chains: 1
• Total formula weight: 16342.49

Authors

Chung, C.,Bamborough, P.,Demont, E. (deposition date: 2015-07-11, release date: 2015-08-12, Last modification date: 2019-05-15)

• Primary citation: Bamborough, P.,Chung, C.,Furze, R.C.,Grandi, P.,Michon, A.,Sheppard, R.J.,Barnett, H.,Diallo, H.,Dixon, D.P.,Douault, C.,Jones, E.J.,Karamshi, B.,Mitchell, D.J.,Prinjha, R.K.,Rau, C.,Watson, R.J.,Werner, T.,Demont, E.H.; Structure-Based Optimization of Naphthyridones Into Potent Atad2 Bromodomain Inhibitors.; J.Med.Chem., 58:6151-, 2015; PubMed: 26230603; DOI: 10.1021/ACS.JMEDCHEM.5B00773

Experimental method

X-RAY DIFFRACTION (2.09 Å)