| Reaction Details |
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 | Report a problem with these data |
| Target | Thiol:disulfide interchange protein DsbA |
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| Ligand | BDBM50539924 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1979824 (CHEMBL4612959) |
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| Kd | 490000±n/a nM |
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| Citation |  Bentley, MR; Ilyichova, OV; Wang, G; Williams, ML; Sharma, G; Alwan, WS; Whitehouse, RL; Mohanty, B; Scammells, PJ; Heras, B; Martin, JL; Totsika, M; Capuano, B; Doak, BC; Scanlon, MJ Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiL J Med Chem63:6863-6875 (2020) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Thiol:disulfide interchange protein DsbA |
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| Name: | Thiol:disulfide interchange protein DsbA |
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| Synonyms: | DSBA_ECOLI | JW3832 | Thiol:disulfide interchange protein DsbA | dsbA | dsf | dsf | ppfA |
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| Type: | PROTEIN |
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| Mol. Mass.: | 23103.76 |
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| Organism: | Escherichia coli (strain K12) |
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| Description: | ChEMBL_109722 |
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| Residue: | 208 |
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| Sequence: | MKKIWLALAGLVLAFSASAAQYEDGKQYTTLEKPVAGAPQVLEFFSFFCPHCYQFEEVLH
ISDNVKKKLPEGVKMTKYHVNFMGGDLGKDLTQAWAVAMALGVEDKVTVPLFEGVQKTQT
IRSASDIRDVFINAGIKGEEYDAAWNSFVVKSLVAQQEKAAADVQLRGVPAMFVNGKYQL
NPQGMDTSNMDVFVQQYADTVKYLSEKK
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| BDBM50539924 |
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| n/a |
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| Name | BDBM50539924 |
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| Synonyms: | CHEMBL4634926 |
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| Type | Small organic molecule |
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| Emp. Form. | C16H13NO3 |
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| Mol. Mass. | 267.2793 |
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| SMILES | Cc1cc(Oc2ccc(CC(O)=O)cc2)ccc1C#N |
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| Structure | 
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