Reaction Details Report a problem with these data
Target
Inorganic pyrophosphatase
Ligand
BDBM205466
Substrate
n/a
Meas. Tech.
Colorimetric Malachite Green Assay
pH
7.5±n/a
Temperature
298.15±n/a K
IC50
4.55e+5± 4.0e+4 nM
Comments
extracted
Citation
 Pang, AH; Garzan, A; Larsen, MJ; McQuade, TJ; Garneau-Tsodikova, S; Tsodikov, OV Discovery of Allosteric and Selective Inhibitors of Inorganic Pyrophosphatase from Mycobacterium tuberculosis. ACS Chem Biol 11:3084-3092 (2016) [PubMed]  Article 
Target
Name:
Inorganic pyrophosphatase
Synonyms:
IPP1 | IPYR_YEAST | Inorganic pyrophosphatase (ScPPiase) | PPA | PPA1
Type:
Protein
Mol. Mass.:
32294.13
Organism:
Saccharomyces cerevisiae (Yeast)
Description:
P00817
Residue:
287
Sequence:
MTYTTRQIGAKNTLEYKVYIEKDGKPVSAFHDIPLYADKENNIFNMVVEIPRWTNAKLEITKEETLNPIIQDTKKGKLRFVRNCFPHHGYIHNYGAFPQTWEDPNVSHPETKAVGDNDPIDVLEIGETIAYTGQVKQVKALGIMALLDEGETDWKVIAIDINDPLAPKLNDIEDVEKYFPGLLRATNEWFRIYKIPDGKPENQFAFSGEAKNKKYALDIIKETHDSWKQLIAGKSSDSKGIDLTNVTLPDTPTYSKAASDAIPPASPKADAPIDKSIDKWFFISGSV
  
Inhibitor
Name:
BDBM205466
Synonyms:
PPiase inhibitor, 9
Type:
Small organic molecule
Emp. Form.:
C25H32N6
Mol. Mass.:
416.5618
SMILES:
C1CCCN(CC1)c1nc(nc(n1)-c1cccn1-c1ccccc1)N1CCCCCC1
Structure:
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