| Reaction Details |
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 | Report a problem with these data |
| Target | Adenosine kinase |
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| Ligand | BDBM50524394 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1892973 (CHEMBL4394894) |
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| Ki | 23±n/a nM |
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| Citation |  Crespo, RA; Dang, Q; Zhou, NE; Guthrie, LM; Snavely, TC; Dong, W; Loesch, KA; Suzuki, T; You, L; Wang, W; O'Malley, T; Parish, T; Olsen, DB; Sacchettini, JC Structure-Guided Drug Design of 6-Substituted Adenosine Analogues as Potent Inhibitors of Mycobacterium tuberculosis Adenosine Kinase. J Med Chem62:4483-4499 (2019) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Adenosine kinase |
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| Name: | Adenosine kinase |
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| Synonyms: | 2.7.1.20 | ADK | ADOK_MYCTU | Adenosine kinase | adoK | cbhK |
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| Type: | PROTEIN |
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| Mol. Mass.: | 34457.04 |
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| Organism: | Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) |
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| Description: | ChEMBL_119021 |
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| Residue: | 324 |
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| Sequence: | MTIAVTGSIATDHLMRFPGRFSEQLLPEHLHKVSLSFLVDDLVMHRGGVAGNMAFAIGVL
GGEVALVGAAGADFADYRDWLKARGVNCDHVLISETAHTARFTCTTDVDMAQIASFYPGA
MSEARNIKLADVVSAIGKPELVIIGANDPEAMFLHTEECRKLGLAFAADPSQQLARLSGE
EIRRLVNGAAYLFTNDYEWDLLLSKTGWSEADVMAQIDLRVTTLGPKGVDLVEPDGTTIH
VGVVPETSQTDPTGVGDAFRAGFLTGRSAGLGLERSAQLGSLVAVLVLESTGTQEWQWDY
EAAASRLAGAYGEHAAAEIVAVLA
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| BDBM50524394 |
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| n/a |
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| Name | BDBM50524394 |
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| Synonyms: | CHEMBL4539148 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H26F2N8O4 |
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| Mol. Mass. | 528.5112 |
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| SMILES | OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(ncnc12)N1CCN(CC1)c1ccc(cc1)-c1cnn(c1)C(F)F |r| |
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| Structure | 
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