Reaction Details |
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Target | Thymidylate kinase |
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Ligand | BDBM50156576 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_429556 (CHEMBL919554) |
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Ki | 80000±n/a nM |
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Citation | Vanheusden, V; Munier-Lehmann, H; Froeyen, M; Busson, R; Rozenski, J; Herdewijn, P; Van Calenbergh, S Discovery of bicyclic thymidine analogues as selective and high-affinity inhibitors of Mycobacterium tuberculosis thymidine monophosphate kinase. J Med Chem47:6187-94 (2004) [PubMed] Article |
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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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BDBM50156576 |
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n/a |
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Name | BDBM50156576 |
Synonyms: | 1-(3-azidomethyl-2,5-difluoro-2,3,5-trideoxy-beta-D-ribofuranosyl)thymine | CHEMBL222970 |
Type | Small organic molecule |
Emp. Form. | C11H13F2N5O3 |
Mol. Mass. | 301.2494 |
SMILES | Cc1cn([C@@H]2O[C@H](CF)[C@@H](CN=[N+]=[N-])[C@H]2F)c(=O)[nH]c1=O |r| |
Structure |
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