Reaction Details |
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Target | DNA gyrase subunit B |
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Ligand | BDBM50605623 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2252312 (CHEMBL5166522) |
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IC50 | 2600±n/a nM |
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Citation | Govender, P; Müller, R; Singh, K; Reddy, V; Eyermann, CJ; Fienberg, S; Ghorpade, SR; Koekemoer, L; Myrick, A; Schnappinger, D; Engelhart, C; Meshanni, J; Byl, JAW; Osheroff, N; Singh, V; Chibale, K; Basarab, GS Spiropyrimidinetrione DNA Gyrase Inhibitors with Potent and Selective Antituberculosis Activity. J Med Chem65:6903-6925 (2022) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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DNA gyrase subunit B |
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Name: | DNA gyrase subunit B |
Synonyms: | 5.6.2.2 | DNA gyrase subunit B | GYRB_MYCTU | gyrB |
Type: | PROTEIN |
Mol. Mass.: | 74087.83 |
Organism: | Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) |
Description: | ChEMBL_109655 |
Residue: | 675 |
Sequence: | MAAQKKKAQDEYGAASITILEGLEAVRKRPGMYIGSTGERGLHHLIWEVVDNAVDEAMAG
YATTVNVVLLEDGGVEVADDGRGIPVATHASGIPTVDVVMTQLHAGGKFDSDAYAISGGL
HGVGVSVVNALSTRLEVEIKRDGYEWSQVYEKSEPLGLKQGAPTKKTGSTVRFWADPAVF
ETTEYDFETVARRLQEMAFLNKGLTINLTDERVTQDEVVDEVVSDVAEAPKSASERAAES
TAPHKVKSRTFHYPGGLVDFVKHINRTKNAIHSSIVDFSGKGTGHEVEIAMQWNAGYSES
VHTFANTINTHEGGTHEEGFRSALTSVVNKYAKDRKLLKDKDPNLTGDDIREGLAAVISV
KVSEPQFEGQTKTKLGNTEVKSFVQKVCNEQLTHWFEANPTDAKVVVNKAVSSAQARIAA
RKARELVRRKSATDIGGLPGKLADCRSTDPRKSELYVVEGDSAGGSAKSGRDSMFQAILP
LRGKIINVEKARIDRVLKNTEVQAIITALGTGIHDEFDIGKLRYHKIVLMADADVDGQHI
STLLLTLLFRFMRPLIENGHVFLAQPPLYKLKWQRSDPEFAYSDRERDGLLEAGLKAGKK
INKEDGIQRYKGLGEMDAKELWETTMDPSVRVLRQVTLDDAAAADELFSILMGEDVDARR
SFITRNAKDVRFLDV
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BDBM50605623 |
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n/a |
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Name | BDBM50605623 |
Synonyms: | CHEMBL5203837 |
Type | Small organic molecule |
Emp. Form. | C23H24FN5O7 |
Mol. Mass. | 501.4644 |
SMILES | [H][C@]12[C@H](C)O[C@H](C)CN1c1c(CC22C(=O)NC(=O)NC2=O)cc2c(OC[C@@H]3CCC(=O)N3)noc2c1F |r| |
Structure |
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