Reaction Details |
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Target | Type 1 fimbrin D-mannose specific adhesin |
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Ligand | BDBM50507953 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1831845 (CHEMBL4331853) |
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IC50 | 92000±n/a nM |
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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 Chem62:467-479 (2019) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Type 1 fimbrin D-mannose specific adhesin |
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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: | MKRVITLFAVLLMGWSVNAWSFACKTANGTAIPIGGGSANVYVNLAPVVNVGQNLVVDLS
TQIFCHNDYPETITDYVTLQRGSAYGGVLSNFSGTVKYSGSSYPFPTTSETPRVVYNSRT
DKPWPVALYLTPVSSAGGVAIKAGSLIAVLILRQTNNYNSDDFQFVWNIYANNDVVVPTG
GCDVSARDVTVTLPDYPGSVPIPLTVYCAKSQNLGYYLSGTTADAGNSIFTNTASFSPAQ
GVGVQLTRNGTIIPANNTVSLGAVGTSAVSLGLTANYARTGGQVTAGNVQSIIGVTFVYQ
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BDBM50507953 |
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n/a |
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Name | BDBM50507953 |
Synonyms: | CHEMBL4436002 |
Type | Small organic molecule |
Emp. Form. | C22H28N2O9S |
Mol. Mass. | 496.531 |
SMILES | COc1cccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)c1-c1cccc(NS(C)(=O)=O)c1 |r| |
Structure |
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