Reaction Details Report a problem with these data
Target
Low molecular weight protein-tyrosine phosphatase A
Ligand
BDBM50312241
Substrate
n/a
Meas. Tech.
ChEMBL_621991 (CHEMBL1106782)
Ki
49700±n/a nM
Citation
 Rawls, KA; Lang, PT; Takeuchi, J; Imamura, S; Baguley, TD; Grundner, C; Alber, T; Ellman, JA Fragment-based discovery of selective inhibitors of the Mycobacterium tuberculosis protein tyrosine phosphatase PtpA. Bioorg Med Chem Lett 19:6851-4 (2009) [PubMed]  Article 
Target
Name:
Low molecular weight protein-tyrosine phosphatase A
Synonyms:
PTPA_MYCTU | PTPase | Probable low molecular weight protein-tyrosine-phosphatase | Protein Tyrosine Phosphatase PTPA | mptpA | ptpA
Type:
Hydrolase
Mol. Mass.:
17891.84
Organism:
Mycobacterium tuberculosis
Description:
n/a
Residue:
163
Sequence:
MSDPLHVTFVCTGNICRSPMAEKMFAQQLRHRGLGDAVRVTSAGTGNWHVGSCADERAAGVLRAHGYPTDHRAAQVGTEHLAADLLVALDRNHARLLRQLGVEAARVRMLRSFDPRSGTHALDVEDPYYGDHSDFEEVFAVIESALPGLHDWVDERLARNGPS
  
Inhibitor
Name:
BDBM50312241
Synonyms:
CHEMBL1081937 | difluoro(4-(2,2,2-trifluoroethylcarbamoyl)phenyl)methylphosphonic acid
Type:
Small organic molecule
Emp. Form.:
C10H9F5NO4P
Mol. Mass.:
333.1485
SMILES:
OP(O)(=O)C(F)(F)c1ccc(cc1)C(=O)NCC(F)(F)F
Structure:
Search PDB for entries with ligand similarity: