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Target
Type 1 fimbrin D-mannose specific adhesin
Ligand
BDBM50507943
Substrate
n/a
Meas. Tech.
ChEMBL_1831845 (CHEMBL4331853)
IC50
280±n/a nM
Citation
 Maddirala, AR; Klein, R; Pinkner, JS; Kalas, V; Hultgren, SJ; Janetka, JW Biphenyl Gal and GalNAc FmlH Lectin Antagonists of Uropathogenic E. coli (UPEC): Optimization through Iterative Rational Drug Design. J Med Chem 62:467-479 (2019) [PubMed]  Article 
Target
Name:
Type 1 fimbrin D-mannose specific adhesin
Synonyms:
Adhesin protein fimH | FIMH_ECOLI | fimH
Type:
PROTEIN
Mol. Mass.:
31474.61
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_1298296
Residue:
300
Sequence:
MKRVITLFAVLLMGWSVNAWSFACKTANGTAIPIGGGSANVYVNLAPVVNVGQNLVVDLSTQIFCHNDYPETITDYVTLQRGSAYGGVLSNFSGTVKYSGSSYPFPTTSETPRVVYNSRTDKPWPVALYLTPVSSAGGVAIKAGSLIAVLILRQTNNYNSDDFQFVWNIYANNDVVVPTGGCDVSARDVTVTLPDYPGSVPIPLTVYCAKSQNLGYYLSGTTADAGNSIFTNTASFSPAQGVGVQLTRNGTIIPANNTVSLGAVGTSAVSLGLTANYARTGGQVTAGNVQSIIGVTFVYQ
  
Inhibitor
Name:
BDBM50507943
Synonyms:
CHEMBL4546828
Type:
Small organic molecule
Emp. Form.:
C19H19NO10
Mol. Mass.:
421.3549
SMILES:
OC[C@H]1O[C@@H](Oc2ccccc2-c2cc(cc(c2)[N+]([O-])=O)C(O)=O)[C@H](O)[C@@H](O)[C@H]1O |r|
Structure:
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