Reaction Details | |||
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Target | Enoyl-[acyl-carrier-protein] reductase [NADH] FabI | ||
Ligand | BDBM50269745 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_2271376 | ||
IC50 | 1800±n/a nM | ||
Citation | Rana, P; Ghouse, SM; Akunuri, R; Madhavi, YV; Chopra, S; Nanduri, S FabI (enoyl acyl carrier protein reductase) - A potential broad spectrum therapeutic target and its inhibitors. Eur J Med Chem208:0 (2020) [PubMed] | ||
More Info.: | Get all data from this article, Assay Method | ||
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI | |||
Name: | Enoyl-[acyl-carrier-protein] reductase [NADH] FabI | ||
Synonyms: | Enoyl - (acyl carrier protein) reductase | Enoyl-ACP Reductase (FabI) | Enoyl-[acyl-carrier-protein] reductase | Enoyl-acyl carrier protein reductase (FabI) | FABI_ECOLI | NADH-dependent enoyl-ACP reductase | envM | fabI | ||
Type: | Enzyme | ||
Mol. Mass.: | 27861.12 | ||
Organism: | Escherichia coli | ||
Description: | n/a | ||
Residue: | 262 | ||
Sequence: |
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BDBM50269745 | |||
n/a | |||
Name | BDBM50269745 | ||
Synonyms: | CHEMBL463175 | Cephalochromin | cid_160115 | ||
Type | Small organic molecule | ||
Emp. Form. | C28H22O10 | ||
Mol. Mass. | 518.4683 | ||
SMILES | CC1CC(=O)c2c(O1)cc1c(c(O)cc(O)c1c2O)-c1c(O)cc(O)c2c(O)c3C(=O)CC(C)Oc3cc12 |(9.64,-2.77,;8.31,-2,;8.3,-.45,;6.96,.33,;6.95,1.87,;5.62,-.45,;5.62,-2.01,;6.96,-2.78,;4.29,-2.78,;2.96,-2.01,;1.63,-2.79,;.29,-2.02,;-1.04,-2.79,;.29,-.47,;1.62,.3,;1.62,1.84,;2.96,-.47,;4.28,.31,;4.28,1.85,;1.63,-4.32,;2.96,-5.08,;4.29,-4.31,;2.97,-6.62,;1.64,-7.4,;1.64,-8.94,;.3,-6.63,;-1.02,-7.4,;-1.02,-8.94,;-2.35,-6.64,;-3.67,-7.42,;-3.66,-8.96,;-5.01,-6.65,;-5.01,-5.12,;-6.35,-4.35,;-3.68,-4.35,;-2.36,-5.1,;-1.03,-4.33,;.3,-5.1,)| | ||
Structure |