Reaction Details Report a problem with these data
Target
Beta-carbonic anhydrase 1
Ligand
BDBM50258792
Substrate
n/a
Meas. Tech.
ChEMBL_519733 (CHEMBL938996)
Ki
7.5±n/a nM
Citation
 Güzel, O; Maresca, A; Scozzafava, A; Salman, A; Balaban, AT; Supuran, CT Discovery of low nanomolar and subnanomolar inhibitors of the mycobacterial beta-carbonic anhydrases Rv1284 and Rv3273. J Med Chem 52:4063-7 (2009) [PubMed]  Article 
Target
Name:
Beta-carbonic anhydrase 1
Synonyms:
Uncharacterized protein Rv1284/MT1322 | β-Carbonic anhydrase 1 (CA 1) | MTCA1_MYCTU | mtcA1 | canA | Carbonic Anhydrase (mtCA 1)
Type:
Enzyme
Mol. Mass.:
18186.06
Organism:
Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Description:
The recombinant GST-mtCA1 construct was cloned, expressed, and further purified from E. coli. The purified protein was used in inhibition assays.
Residue:
163
Sequence:
MTVTDDYLANNVDYASGFKGPLPMPPSKHIAIVACMDARLDVYRMLGIKEGEAHVIRNAGCVVTDDVIRSLAISQRLLGTREIILLHHTDCGMLTFTDDDFKRAIQDETGIRPTWSPESYPDAVEDVRQSLRRIEVNPFVTKHTSLRGFVFDVATGKLNEVTP
  
Inhibitor
Name:
BDBM50258792
Synonyms:
3-phenyl-5-sulfamoyl-1H-indole-2-carboxamide | CHEMBL512633
Type:
Small organic molecule
Emp. Form.:
C15 H13 N3 O3 S
Mol. Mass.:
315.34702
SMILES:
NC(=O)c1[nH]c2ccc(S(N)(=O)=O)cc2c1-c1ccccc1
Structure:
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