4A6L

beta-tryptase inhibitor

Summary for 4A6L

• Entry DOI: 10.2210/pdb4a6l/pdb
• Related: 1AAO
• Descriptor: TRYPTASE ALPHA/BETA-1, 1-{3-[1-({5-[(2-fluorophenyl)ethynyl]furan-2-yl}carbonyl)piperidin-4-yl]phenyl}methanamine (3 entities in total)
• Functional Keywords: hydrolase, inhibitor
• Biological source: HOMO SAPIENS (HUMAN)
• Cellular location: Secreted: Q15661
• Total number of polymer chains: 4
• Total formula weight: 111575.55

Authors

Mathieu, M.,Maignan, S. (deposition date: 2011-11-04, release date: 2012-01-25)

• Primary citation: Liang, G.,Aldous, S.,Merriman, G.,Levell, J.,Pribish, J.,Cairns, J.,Chen, X.,Maignan, S.,Mathieu, M.,Tsay, J.,Sides, K.,Rebello, S.,Whitely, B.,Morize, I.,Pauls, H.W.; Structure-Based Library Design and the Discovery of a Potent and Selective Mast Cell Beta-Tryptase Inhibitor as an Oral Therapeutic Agent.; Bioorg.Med.Chem.Lett., 22:1049-, 2012; PubMed: 22192588; DOI: 10.1016/J.BMCL.2011.11.119

Experimental method

X-RAY DIFFRACTION (2.05 Å)