Reaction Details |
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Target | Thymidylate kinase |
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Ligand | BDBM50366828 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_208219 (CHEMBL816310) |
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Ki | 30000±n/a nM |
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Citation | Vanheusden, V; Van Rompaey, P; Munier-Lehmann, H; Pochet, S; Herdewijn, P; Van Calenbergh, S Thymidine and thymidine-5'-O-monophosphate analogues as inhibitors of Mycobacterium tuberculosis thymidylate kinase. Bioorg Med Chem Lett13:3045-8 (2003) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Thymidylate kinase |
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Name: | Thymidylate kinase |
Synonyms: | KTHY_MYCTU | TMPK | Thymidine monophosphate kinase | dTMP kinase | tmk |
Type: | PROTEIN |
Mol. Mass.: | 22636.29 |
Organism: | Mycobacterium tuberculosis |
Description: | ChEMBL_208218 |
Residue: | 214 |
Sequence: | MLIAIEGVDGAGKRTLVEKLSGAFRAAGRSVATLAFPRYGQSVAADIAAEALHGEHGDLA
SSVYAMATLFALDRAGAVHTIQGLCRGYDVVILDRYVASNAAYSAARLHENAAGKAAAWV
QRIEFARLGLPKPDWQVLLAVSAELAGERSRGRAQRDPGRARDNYERDAELQQRTGAVYA
ELAAQGWGGRWLVVGADVDPGRLAATLAPPDVPS
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BDBM50366828 |
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n/a |
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Name | BDBM50366828 |
Synonyms: | CHEMBL1236157 |
Type | Small organic molecule |
Emp. Form. | C20H30N7O23P5 |
Mol. Mass. | 891.3541 |
SMILES | Cc1cn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c(N)ncnc34)O2)c(=O)[nH]c1=O |r| |
Structure |
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