Reaction Details |
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Target | Flavin-dependent thymidylate synthase |
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Ligand | BDBM50351770 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_764951 (CHEMBL1827108) |
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IC50 | >50000±n/a nM |
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Citation | Kögler, M; Vanderhoydonck, B; De Jonghe, S; Rozenski, J; Van Belle, K; Herman, J; Louat, T; Parchina, A; Sibley, C; Lescrinier, E; Herdewijn, P Synthesis and evaluation of 5-substituted 2'-deoxyuridine monophosphate analogues as inhibitors of flavin-dependent thymidylate synthase in Mycobacterium tuberculosis. J Med Chem54:4847-62 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Flavin-dependent thymidylate synthase |
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Name: | Flavin-dependent thymidylate synthase |
Synonyms: | THYX_MYCTU | TS | TSase | Thymidylate synthase thyX | thyX |
Type: | PROTEIN |
Mol. Mass.: | 27593.46 |
Organism: | Mycobacterium tuberculosis |
Description: | ChEMBL_764951 |
Residue: | 250 |
Sequence: | MAETAPLRVQLIAKTDFLAPPDVPWTTDADGGPALVEFAGRACYQSWSKPNPKTATNAGY
LRHIIDVGHFSVLEHASVSFYITGISRSCTHELIRHRHFSYSQLSQRYVPEKDSRVVVPP
GMEDDADLRHILTEAADAARATYSELLAKLEAKFADQPNAILRRKQARQAARAVLPNATE
TRIVVTGNYRAWRHFIAMRASEHADVEIRRLAIECLRQLAAVAPAVFADFEVTTLADGTE
VATSPLATEA
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BDBM50351770 |
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n/a |
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Name | BDBM50351770 |
Synonyms: | CHEMBL1823499 |
Type | Small organic molecule |
Emp. Form. | C20H28N3O10P |
Mol. Mass. | 501.4253 |
SMILES | CCCCNC(=O)CCCCC#Cc1cn([C@@H]2O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O |r| |
Structure |
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