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4MQA

Human beta-tryptase co-crystal structure with {(1,1,3,3-tetramethyldisiloxane-1,3-diyl)bis[5-(methylsulfanyl)benzene-3,1-diyl]}bis({4-[3-(aminomethyl)phenyl]piperidin-1-yl}methanone)

Summary for 4MQA
Entry DOI10.2210/pdb4mqa/pdb
Related4MPU 4MPV 4MPW 4MPX
DescriptorTryptase alpha/beta-1, SULFATE ION, TETRAETHYLENE GLYCOL, ... (5 entities in total)
Functional Keywordscoferon, alpha-hydroxyketone, small molecule inhibitor, drug discovery, self-assembly, crystal catalysis, silanol, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological sourceHomo sapiens (human)
Cellular locationSecreted: Q15661
Total number of polymer chains2
Total formula weight56468.65
Authors
White, A.,Lakshminarasimhan, D.,Suto, R. (deposition date: 2013-09-16, release date: 2015-03-18)
Primary citationGiardina, S.F.,Pingle, M.,Foreman, K.W.,Werner, D.S.,Bergstrom, D.E.,Barany, F.,Arnold, L.D.
Target-directed self-assembly of homodimeric drugs
To be Published,
Experimental method
X-RAY DIFFRACTION (2.25 Å)
Structure validation

217705

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