| Reaction Details |
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 | Report a problem with these data |
| Target | DNA gyrase subunit B |
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| Ligand | BDBM50018288 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1361407 (CHEMBL3294031) |
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| IC50 | >100000±n/a nM |
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| Citation |  Hameed P, S; Patil, V; Solapure, S; Sharma, U; Madhavapeddi, P; Raichurkar, A; Chinnapattu, M; Manjrekar, P; Shanbhag, G; Puttur, J; Shinde, V; Menasinakai, S; Rudrapatana, S; Achar, V; Awasthy, D; Nandishaiah, R; Humnabadkar, V; Ghosh, A; Narayan, C; Ramya, VK; Kaur, P; Sharma, S; Werngren, J; Hoffner, S; Panduga, V; Kumar, CN; Reddy, J; Kumar K N, M; Ganguly, S; Bharath, S; Bheemarao, U; Mukherjee, K; Arora, U; Gaonkar, S; Coulson, M; Waterson, D; Sambandamurthy, VK; de Sousa, SM Novel N-linked aminopiperidine-based gyrase inhibitors with improved hERG and in vivo efficacy against Mycobacterium tuberculosis. J Med Chem57:4889-905 (2014) [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 |
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| Synonyms: | GYRB_MYCSM | gyrB |
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| Type: | PROTEIN |
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| Mol. Mass.: | 74505.25 |
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| Organism: | Mycobacterium smegmatis |
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| Description: | ChEMBL_107961 |
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| Residue: | 675 |
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| Sequence: | MAAQKNNAPKEYGADSITILEGLEAVRKRPGMYIGSTGERGLHHLIWEVVDNAVDEAMAG
FATRVDVKIHADGSVEVRDDGRGIPVEMHATGMPTIDVVMTQLHAGGKFDGETYAVSGGL
HGVGVSVVNALSTRLEATVLRDGYEWFQYYDRSVPGKLKQGGETKETGTTIRFWADPEIF
ETTDYNFETVARRLQEMAFLNKGLTIELTDERVTAEEVVDDVVKDTAEAPKTADEKAAEA
TGPSKVKHRVFHYPGGLVDYVKHINRTKTPIQQSIIDFDGKGPGHEVEIAMQWNAGYSES
VHTFANTINTHEGGTHEEGFRAALTSVVNRYAKDKKLLKDKDPNLTGDDIREGLAAVISV
KVAEPQFEGQTKTKLGNTEVKSFVQKICNEQLQHWFEANPAEAKTVVNKAVSSAQARIAA
RKARELVRRKSATDIGGLPGKLADCRSTDPSKSELYVVEGDSAGGSAKSGRDSMFQAILP
LRGKIINVEKARIDRVLKNTEVQSIITALGTGIHDEFDISKLRYHKIVLMADADVDGQHI
STLLLTLLFRFMKPLVENGHIFLAQPPLYKLKWQRSEPEFAYSDRERDGLLEAGRAAGKK
INVDDGIQRYKGLGEMDAKELWETTMDPSVRVLRQVTLDDAAAADELFSILMGEDVEARR
SFITRNAKDVRFLDV
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| BDBM50018288 |
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| n/a |
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| Name | BDBM50018288 |
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| Synonyms: | CHEMBL3290336 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H28N6O4 |
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| Mol. Mass. | 464.5169 |
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| SMILES | COc1ccc2ccc(=O)n(CCN3CCC(CC3)NCc3ccc4OCC(=O)Nc4n3)c2n1 |
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| Structure | 
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