| Reaction Details |
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 | Report a problem with these data |
| Target | Tyrosine--tRNA ligase |
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| Ligand | BDBM199134 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | In vitro Enzyme Inhibition Assay |
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| pH | 7.9±n/a |
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| IC50 | 9.2e+2± 2.6e+2 nM |
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| Comments | extracted |
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| Citation |  Chen, LW; Wang, PF; Tang, DJ; Tao, XX; Man, RJ; Qiu, HY; Wang, ZC; Xu, C; Zhu, HL Metronidazole containing pyrazole derivatives potently inhibit tyrosyl-tRNA synthetase: design, synthesis, and biological evaluation. Chem Biol Drug Des88:592-8 (2016) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Tyrosine--tRNA ligase |
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| Name: | Tyrosine--tRNA ligase |
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| Synonyms: | SYY_STAAS | Tyrosyl-tRNA synthetase | tyrS |
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| Type: | Protein |
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| Mol. Mass.: | 47586.43 |
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| Organism: | Staphylococcus aureus (strain MSSA476) |
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| Description: | n/a |
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| Residue: | 420 |
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| Sequence: | MTNVLIEDLKWRGLIYQQTDEQGIEDLLNKEQVTLYCGADPTADSLHIGHLLPFLTLRRF
QEHGHRPIVLIGGGTGMIGDPSGKSEERVLQTEEQVDKNIEGISKQMHNIFEFGTDHGAV
LVNNRDWLGQISLISFLRDYGKHVGVNYMLGKDSIQSRLEHGISYTEFTYTILQAIDFGH
LNRELNCKIQVGGSDQWGNITSGIELMRRMYGQTDAYGLTIPLVTKSDGKKFGKSESGAV
WLDAEKTSPYEFYQFWINQSDEDVIKFLKYFTFLGKEEIDRLEQSKNEAPHLREAQKTLA
EEVTKFIHGEDALNDAIRISQALFSGDLKSLSAKELKDGFKDVPQVTLSNDTTNIVEVLI
ETGISPSKRQAREDVNNGAIYINGERQQDVNYALAPEDKIDGEFTIIRRGKKKYFMVNYQ
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| BDBM199134 |
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| n/a |
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| Name | BDBM199134 |
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| Synonyms: | 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)-ethyl-5-(4-methoxyphenyl)-1-phenyl-1H-pyrazole-3-carboxylate (4f) |
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| Type | Small organic molecule |
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| Emp. Form. | C23H21N5O5 |
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| Mol. Mass. | 447.4433 |
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| SMILES | COc1ccc(cc1)-c1cc(nn1-c1ccccc1)C(=O)OCCn1c(C)ncc1[N+]([O-])=O |
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| Structure | 
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