| Reaction Details |
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 | Report a problem with these data |
| Target | Thymidylate synthase |
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| Ligand | BDBM82175 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Tritium Release Assay |
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| pH | 7.5±0 |
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| Temperature | 277.15±0 K |
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| IC50 | 7.0e+4±n/a nM |
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| Kd | 2e+3±n/a nM |
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| Citation |  Begley, DW; Zheng, S; Varani, G Fragment-based discovery of novel thymidylate synthase leads by NMR screening and group epitope mapping. Chem Biol Drug Des76:218-33 (2010) [PubMed] Article |
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| More Info.: | Get all data from this article, Solution Info, Assay Method |
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| Thymidylate synthase |
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| Name: | Thymidylate synthase |
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| Synonyms: | TS | TSase | TYMS | TYSY_HUMAN | Thymidylate synthase (TS) | Thymidylate synthase/GAR transformylase/AICAR transformylase |
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| Type: | Enzyme |
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| Mol. Mass.: | 35718.07 |
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| Organism: | Homo sapiens (Human) |
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| Description: | n/a |
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| Residue: | 313 |
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| Sequence: | MPVAGSELPRRPLPPAAQERDAEPRPPHGELQYLGQIQHILRCGVRKDDRTGTGTLSVFG
MQARYSLRDEFPLLTTKRVFWKGVLEELLWFIKGSTNAKELSSKGVKIWDANGSRDFLDS
LGFSTREEGDLGPVYGFQWRHFGAEYRDMESDYSGQGVDQLQRVIDTIKTNPDDRRIIMC
AWNPRDLPLMALPPCHALCQFYVVNSELSCQLYQRSGDMGLGVPFNIASYALLTYMIAHI
TGLKPGDFIHTLGDAHIYLNHIEPLKIQLQREPRPFPKLRILRKVEKIDDFKAEDFQIEG
YNPHPTIKMEMAV
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| BDBM82175 |
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| n/a |
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| Name | BDBM82175 |
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| Synonyms: | MV1570 |
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| Type | Small organic molecule |
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| Emp. Form. | C22H19N3O2S2 |
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| Mol. Mass. | 421.535 |
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| SMILES | O=C(NCCc1c[nH]c2ccccc12)C(\NC(=O)c1cccs1)=C/c1cccs1 |
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| Structure | 
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