2EXG

Making Protein-Protein Interactions Drugable: Discovery of Low-Molecular-Weight Ligands for the AF6 PDZ Domain

Summary for 2EXG

• Entry DOI: 10.2210/pdb2exg/pdb
• Descriptor: Afadin, (5R)-2-SULFANYL-5-[4-(TRIFLUOROMETHYL)BENZYL]-1,3-THIAZOL-4-ONE (2 entities in total)
• Functional Keywords: inhibitors of protein-protein interactions, low-molecular-weight ligands, protein structure, nmr screening, pdz domains, cell adhesion
• Biological source: Homo sapiens (human)
• Cellular location: Cell junction, adherens junction: P55196
• Total number of polymer chains: 1
• Total formula weight: 10684.30

Authors

Joshi, M.,Vargas, C.,Boisguerin, P.,Krause, G.,Schade, M.,Oschkinat, H. (deposition date: 2005-11-08, release date: 2006-10-17, Last modification date: 2022-03-09)

• Primary citation: Joshi, M.,Vargas, C.,Boisguerin, P.,Diehl, A.,Krause, G.,Schmieder, P.,Moelling, K.,Hagen, V.,Schade, M.,Oschkinat, H.; Discovery of low-molecular-weight ligands for the AF6 PDZ domain.; Angew.Chem.Int.Ed.Engl., 45:3790-3795, 2006; PubMed: 16671149; DOI: 10.1002/anie.200503965

Experimental method

SOLUTION NMR