5MAJ

CATHEPSIN L IN COMPLEX WITH 4-[cyclopentyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]-6-morpholino-1,3,5-triazine-2-carbonitrile

Summary for 5MAJ

• Entry DOI: 10.2210/pdb5maj/pdb
• Related: 5MAE
• Descriptor: Cathepsin L1, ~{N}-cyclopentyl-~{N}-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-(iminomethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine, 1,2-ETHANEDIOL, ... (4 entities in total)
• Functional Keywords: protease inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase
• Biological source: Homo sapiens (Human)
• Cellular location: Lysosome: P07711
• Total number of polymer chains: 1
• Total formula weight: 24660.25

Authors

Kuglstatter, A.,Stihle, M.,Benz, J. (deposition date: 2016-11-03, release date: 2017-01-11, Last modification date: 2017-02-22)

• Primary citation: Giroud, M.,Ivkovic, J.,Martignoni, M.,Fleuti, M.,Trapp, N.,Haap, W.,Kuglstatter, A.,Benz, J.,Kuhn, B.,Schirmeister, T.,Diederich, F.; Inhibition of the Cysteine Protease Human Cathepsin L by Triazine Nitriles: AmideHeteroarene pi-Stacking Interactions and Chalcogen Bonding in the S3 Pocket.; ChemMedChem, 12:257-270, 2017; PubMed: 27992115; DOI: 10.1002/cmdc.201600563

Experimental method

X-RAY DIFFRACTION (1 Å)