Reaction Details |
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Target | Thymidylate synthase |
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Ligand | BDBM50350126 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_760998 (CHEMBL1815026) |
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Ki | 3000±n/a nM |
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Citation | Mangani, S; Cancian, L; Leone, R; Pozzi, C; Lazzari, S; Luciani, R; Ferrari, S; Costi, MP Identification of the binding modes of N-phenylphthalimides inhibiting bacterial thymidylate synthase through X-ray crystallography screening. J Med Chem54:5454-67 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Thymidylate synthase |
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Name: | Thymidylate synthase |
Synonyms: | TSase | TYSY_LACCA | Thymidylate Synthase (TS) | Thymidylate synthase | thyA |
Type: | Enzyme |
Mol. Mass.: | 36576.54 |
Organism: | Lactobacillus casei |
Description: | n/a |
Residue: | 316 |
Sequence: | MLEQPYLDLAKKVLDEGHFKPDRTHTGTYSIFGHQMRFDLSKGFPLLTTKKVPFGLIKSE
LLWFLHGDTNIRFLLQHRNHIWDEWAFEKWVKSDEYHGPDMTDFGHRSQKDPEFAAVYHE
EMAKFDDRVLHDDAFAAKYGDLGLVYGSQWRAWHTSKGDTIDQLGDVIEQIKTHPYSRRL
IVSAWNPEDVPTMALPPCHTLYQFYVNDGKLSLQLYQRSADIFLGVPFNIASYALLTHLV
AHECGLEVGEFIHTFGDAHLYVNHLDQIKEQLSRTPRPAPTLQLNPDKHDIFDFDMKDIK
LLNYDPYPAIKAPVAV
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BDBM50350126 |
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n/a |
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Name | BDBM50350126 |
Synonyms: | CHEMBL1231545 |
Type | Small organic molecule |
Emp. Form. | C21H15NO3 |
Mol. Mass. | 329.3487 |
SMILES | Cc1cccc2C(=O)N(C(=O)c12)c1cc(ccc1O)-c1ccccc1 |
Structure |
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