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Target
Disintegrin and metalloproteinase domain-containing protein 17 [215-477,S266A,N452Q]
Ligand
BDBM26552
Substrate
TACE Substrate Peptide
Meas. Tech.
TACE Inhibition Assay
pH
7.5±n/a
Temperature
295.15±n/a K
Ki
27±n/a nM
Citation
 Govinda Rao, B; Bandarage, UK; Wang, T; Come, JH; Perola, E; Wei, Y; Tian, SK; Saunders, JO Novel thiol-based TACE inhibitors: rational design, synthesis, and SAR of thiol-containing aryl sulfonamides. Bioorg Med Chem Lett 17:2250-3 (2007) [PubMed]  Article
Target
Name:
Disintegrin and metalloproteinase domain-containing protein 17 [215-477,S266A,N452Q]
Synonyms:
A disintegrin and metalloproteinase domain 17 | ADA17_HUMAN | ADAM 17 | ADAM17 | CD156b antigen | CSVP | Snake venom-like protease | TACE | TNF-alpha-Converting Enzyme
Type:
Single-pass type I membrane protein; metalloprotease
Mol. Mass.:
29695.98
Organism:
Homo sapiens (Human)
Description:
The catalytic domain of recombinant human TNF-converting enzyme (residues 215-477) with two mutations (S266A and N452Q) and a 6xHis was purified from the baculovirus/Hi5 cells expression system.
Residue:
263
Sequence:
RADPDPMKNTCKLLVVADHRFYRYMGRGEESTTTNYLIELIDRVDDIYRNTAWDNAGFKGYGIQIEQIRILKSPQEVKPGEKHYNMAKSYPNEEKDAWDVKMLLEQFSFDIAEEASKVCLAHLFTYQDFDMGTLGLAYVGSPRANSHGGVCPKAYYSPVGKKNIYLNSGLTSTKNYGKTILTKEADLVTTHELGHNFGAEHDPDGLAECAPNEDQGGKYVMYPIAVSGDHENNKMFSQCSKQSIYKTIESKAQECFQERSNKV
  
Inhibitor
Name:
BDBM26552
Synonyms:
4-(but-2-yn-1-yloxy)-N-methyl-N-[(2S)-2-sulfanylpropyl]benzene-1-sulfonamide | butynyloxy containing compound, 3
Type:
Small organic molecule
Emp. Form.:
C14H19NO3S2
Mol. Mass.:
313.436
SMILES:
CC#CCOc1ccc(cc1)S(=O)(=O)N(C)C[C@H](C)S |r|
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
TACE Substrate Peptide
Synonyms:
Bachem M-2155 | DABCYL-TNF-alpha-EDANS (-4 to +6) (human)
Type:
Internally quenched peptide
Mol. Mass.:
4104.44
Organism:
n/a
Description:
n/a
Residue:
39
Sequence:
DACYLLEALAGLNALAVALARGSERSERSERARGEDANS