Target
3-dehydroquinate dehydratase
Ligand
BDBM50352034
Substrate
n/a
Meas. Tech.
ChEMBL_766424 (CHEMBL1826564)
Ki
6700±n/a nM
Citation
 Tizón, LOtero, JMPrazeres, VFLlamas-Saiz, ALFox, GCvan Raaij, MJLamb, HHawkins, ARAinsa, JACastedo, LGonzález-Bello, C A prodrug approach for improving antituberculosis activity of potent Mycobacterium tuberculosis type II dehydroquinase inhibitors. J Med Chem 54:6063-84 (2011) [PubMed]  Article 
Target
Name:
3-dehydroquinate dehydratase
Synonyms:
AROQ_HELPY | aroQ
Type:
PROTEIN
Mol. Mass.:
18479.08
Organism:
Helicobacter pylori
Description:
ChEMBL_766424
Residue:
167
Sequence:
MKILVIQGPNLNMLGHRDPRLYGMVTLDQIHEIMQTFVKQGNLDVELEFFQTNFEGEIIDKIQESVGSDYEGIIINPGAFSHTSIAIADAIMLAGKPVIEVHLTNIQAREEFRKNSYTGAACGGVIMGFGPLGYNMALMAMVNILAEMKAFQEAQKNNPNNPINNQK
  
Inhibitor
Name:
BDBM50352034
Synonyms:
CHEMBL1823564
Type:
Small organic molecule
Emp. Form.:
C25H19Cl2O6S2
Mol. Mass.:
550.451
SMILES:
O[C@@H]1C[C@](O)(C([O-])=O)C(Cc2cc3ccc(Cl)cc3s2)=C(OCc2cc3ccc(Cl)cc3s2)[C@H]1O |r,t:21|
Structure:
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