Reaction Details | |||
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Target | Glutamate racemase | ||
Ligand | BDBM50421060 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_842443 (CHEMBL2092116) | ||
IC50 | 72±n/a nM | ||
Citation | Basarab, GS; Hill, P; Eyermann, CJ; Gowravaram, M; Käck, H; Osimoni, E Design of inhibitors of Helicobacter pylori glutamate racemase as selective antibacterial agents: incorporation of imidazoles onto a core pyrazolopyrimidinedione scaffold to improve bioavailabilty. Bioorg Med Chem Lett22:5600-7 (2012) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Glutamate racemase | |||
Name: | Glutamate racemase | ||
Synonyms: | MURI_HELPJ | glr | murI | ||
Type: | PROTEIN | ||
Mol. Mass.: | 28499.39 | ||
Organism: | Helicobacter pylori J99 | ||
Description: | ChEMBL_842443 | ||
Residue: | 255 | ||
Sequence: |
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BDBM50421060 | |||
n/a | |||
Name | BDBM50421060 | ||
Synonyms: | CHEMBL2087850 | ||
Type | Small organic molecule | ||
Emp. Form. | C25H24ClN7O2 | ||
Mol. Mass. | 489.957 | ||
SMILES | CCn1c(=O)n(CC2CC2)c2nn(Cc3ccnc4ccc(Cl)cc34)c(-c3cncn3C)c2c1=O |(-8.44,-41.43,;-8.44,-42.97,;-7.1,-43.74,;-7.1,-45.28,;-8.43,-46.05,;-5.77,-46.04,;-5.77,-47.58,;-7.11,-48.35,;-8.65,-48.36,;-7.88,-49.69,;-4.44,-45.28,;-2.98,-45.76,;-2.07,-44.51,;-.53,-44.51,;.24,-45.84,;-.53,-47.17,;.24,-48.51,;1.78,-48.51,;2.54,-47.16,;4.07,-47.15,;4.83,-45.83,;4.05,-44.5,;4.81,-43.16,;2.53,-44.51,;1.78,-45.84,;-2.98,-43.26,;-2.18,-41.95,;-.65,-41.81,;-.3,-40.31,;-1.62,-39.52,;-2.78,-40.53,;-4.28,-40.18,;-4.44,-43.74,;-5.77,-42.96,;-5.77,-41.42,)| | ||
Structure |