3NOX

Crystal structure of human DPP-IV in complex with Sa-(+)-(6-(aminomethyl)-5-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-2-yl)(morpholino)methanone

Summary for 3NOX

• Entry DOI: 10.2210/pdb3nox/pdb
• Related: 3BJM 3Q0T 3SWW 3SX4
• Descriptor: Dipeptidyl-peptidase 4 (CD26, adenosine deaminase complexing protein 2), 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, ... (6 entities in total)
• Functional Keywords: exopeptidase, alpha/beta hydrolase fold, beta barrel, beta propeller, dpp4, dimer, protein:inhibitor complex, aminopeptidase, glycoprotein, membrane, protease, secreted, serine protease, signal-anchor, transmembrane, hydrolase
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 178895.25

Authors

Klei, H.E. (deposition date: 2010-06-25, release date: 2010-08-11, Last modification date: 2023-09-06)

• Primary citation: Meng, W.,Brigance, R.P.,Chao, H.J.,Fura, A.,Harrity, T.,Marcinkeviciene, J.,O'Connor, S.P.,Tamura, J.K.,Xie, D.,Zhang, Y.,Klei, H.E.,Kish, K.,Weigelt, C.A.,Turdi, H.,Wang, A.,Zahler, R.,Kirby, M.S.,Hamann, L.G.; Discovery of 6-(Aminomethyl)-5-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyrimidine-2-carboxamides as Potent, Selective Dipeptidyl Peptidase-4 (DPP4) Inhibitors.; J.Med.Chem., 53:5620-5628, 2010; PubMed: 20684603; DOI: 10.1021/jm100634a

Experimental method

X-RAY DIFFRACTION (2.338 Å)