Reaction Details |
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Target | NH(3)-dependent NAD(+) synthetase |
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Ligand | BDBM50278416 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_564355 (CHEMBL957657) |
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IC50 | 186000±n/a nM |
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Citation | Moro, WB; Yang, Z; Kane, TA; Brouillette, CG; Brouillette, WJ Virtual screening to identify lead inhibitors for bacterial NAD synthetase (NADs). Bioorg Med Chem Lett19:2001-5 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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NH(3)-dependent NAD(+) synthetase |
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Name: | NH(3)-dependent NAD(+) synthetase |
Synonyms: | BAS1855 | BA_1998 | GBAA_1998 | NADE_BACAN | Nicotinamide adenine dinucleotide synthetase (NADs) | nadE |
Type: | Enzyme |
Mol. Mass.: | 30092.16 |
Organism: | Bacillus anthracis |
Description: | Q81RP3 |
Residue: | 272 |
Sequence: | MTLQEQIMKALHVQPVIDPKAEIRKRVDFLKDYVKKTGAKGFVLGISGGQDSTLAGRLAQ
LAVEEIRNEGGNATFIAVRLPYKVQKDEDDAQLALQFIQADQSVAFDIASTVDAFSNQYE
NLLDESLTDFNKGNVKARIRMVTQYAIGGQKGLLVIGTDHAAEAVTGFFTKFGDGGADLL
PLTGLTKRQGRALLQELGADERLYLKMPTADLLDEKPGQADETELGITYDQLDDYLEGKT
VPADVAEKIEKRYTVSEHKRQVPASMFDDWWK
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BDBM50278416 |
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n/a |
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Name | BDBM50278416 |
Synonyms: | 2-(3-(3-nitrobenzoyl)thioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide | CHEMBL469773 |
Type | Small organic molecule |
Emp. Form. | C17H16N4O4S2 |
Mol. Mass. | 404.463 |
SMILES | NC(=O)c1c(NC(=S)NC(=O)c2cccc(c2)[N+]([O-])=O)sc2CCCCc12 |
Structure |
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