3UUZ

Bovine trypsin variant X(triplePhe227) in complex with small molecule inhibitor

Summary for 3UUZ

• Entry DOI: 10.2210/pdb3uuz/pdb
• Related: 1V2K 3UNP 3UNQ 3UNS 3UPE 3UQO 3UQV
• Descriptor: Cationic trypsin, CALCIUM ION, {[(7-carbamimidoylnaphthalen-2-yl)methyl][4-({1-[(1E)-ethanimidoyl]piperidin-4-yl}oxy)phenyl]sulfamoyl}acetic acid, ... (5 entities in total)
• Functional Keywords: trypsin-like serine protease, hydrolase, protein binding, duodenum, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Bos taurus (bovine)
• Total number of polymer chains: 2
• Total formula weight: 48280.51

Authors

Tziridis, A.,Neumann, P.,Kolenko, P.,Stubbs, M.T. (deposition date: 2011-11-29, release date: 2012-12-05, Last modification date: 2023-09-13)

• Primary citation: Tziridis, A.,Rauh, D.,Neumann, P.,Kolenko, P.,Menzel, A.,Brauer, U.,Ursel, C.,Steinmetzer, P.,Sturzebecher, J.,Schweinitz, A.,Steinmetzer, T.,Stubbs, M.T.; Correlating structure and ligand affinity in drug discovery: a cautionary tale involving second shell residues.; Biol.Chem., 395:891-903, 2014; PubMed: 25003390; DOI: 10.1515/hsz-2014-0158

Experimental method

X-RAY DIFFRACTION (2.1 Å)