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Target
Beta-glucuronidase
Ligand
BDBM50539702
Substrate
n/a
Meas. Tech.
ChEMBL_1978620 (CHEMBL4611755)
IC50
4020±n/a nM
Citation
 Yang, F; Zhu, W; Sun, S; Ai, Q; Edirisuriya, P; Zhou, K Isolation and Structural Characterization of Specific Bacterial ?-Glucuronidase Inhibitors from Noni ( J Nat Prod 83:825-833 (2020) [PubMed]  Article 
Target
Name:
Beta-glucuronidase
Synonyms:
β-Glucuronidase | BGLR_ECOLI | Beta-glucuronidase (EcGUS) | gurA | gusA | uidA
Type:
Protein
Mol. Mass.:
68431.57
Organism:
Escherichia coli (Enterobacteria)
Description:
P05804
Residue:
603
Sequence:
MLRPVETPTREIKKLDGLWAFSLDRENCGIDQRWWESALQESRAIAVPGSFNDQFADADIRNYAGNVWYQREVFIPKGWAGQRIVLRFDAVTHYGKVWVNNQEVMEHQGGYTPFEADVTPYVIAGKSVRITVCVNNELNWQTIPPGMVITDENGKKKQSYFHDFFNYAGIHRSVMLYTTPNTWVDDITVVTHVAQDCNHASVDWQVVANGDVSVELRDADQQVVATGQGTSGTLQVVNPHLWQPGEGYLYELCVTAKSQTECDIYPLRVGIRSVAVKGEQFLINHKPFYFTGFGRHEDADLRGKGFDNVLMVHDHALMDWIGANSYRTSHYPYAEEMLDWADEHGIVVIDETAAVGFNLSLGIGFEAGNKPKELYSEEAVNGETQQAHLQAIKELIARDKNHPSVVMWSIANEPDTRPQGAREYFAPLAEATRKLDPTRPITCVNVMFCDAHTDTISDLFDVLCLNRYYGWYVQSGDLETAEKVLEKELLAWQEKLHQPIIITEYGVDTLAGLHSMYTDMWSEEYQCAWLDMYHRVFDRVSAVVGEQVWNFADFATSQGILRVGGNKKGIFTRDRKPKSAAFLLQKRWTGMNFGEKPQQGGKQ
  
Inhibitor
Name:
BDBM50539702
Synonyms:
CHEMBL4633555
Type:
Small organic molecule
Emp. Form.:
C27H26O9
Mol. Mass.:
494.4899
SMILES:
OC\C=C\c1ccc2O[C@H]([C@H](CO)Oc2c1)c1ccc2O[C@@H]([C@@H](CO)Oc2c1)c1ccc(O)c(O)c1 |r|
Structure:
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