Reaction Details Report a problem with these data
Target
Enoyl-[acyl-carrier-protein] reductase [NADH]
Ligand
BDBM50436718
Substrate
n/a
Meas. Tech.
ChEMBL_966863 (CHEMBL2401007)
Ki
7000±n/a nM
Citation
 Hu, X; Compton, JR; Abdulhameed, MD; Marchand, CL; Robertson, KL; Leary, DH; Jadhav, A; Hershfield, JR; Wallqvist, A; Friedlander, AM; Legler, PM 3-substituted indole inhibitors against Francisella tularensis FabI identified by structure-based virtual screening. J Med Chem 56:5275-87 (2014) [PubMed]  Article 
Target
Name:
Enoyl-[acyl-carrier-protein] reductase [NADH]
Synonyms:
fabI
Type:
PROTEIN
Mol. Mass.:
27804.42
Organism:
Francisella tularensis subsp. tularensis (strain SCHU S4 / Schu 4)
Description:
Q5NGQ3
Residue:
260
Sequence:
MGFLAGKKILITGLLSNKSIAYGIAKAMHREGAELAFTYVGQFKDRVEKLCAEFNPAAVLPCDVISDQEIKDLFVELGKVWDGLDAIVHSIAFAPRDQLEGNFIDCVTREGFSIAHDISAYSFAALAKEGRSMMKNRNASMVALTYIGAEKAMPSYNTMGVAKASLEATVRYTALALGEDGIKVNAVSAGPIKTLAASGISNFKKMLDYNAMVSPLKKNVDIMEVGNTVAFLCSDMATGITGEVVHVDAGYHCVSMGNVL
  
Inhibitor
Name:
BDBM50436718
Synonyms:
CHEMBL1341978
Type:
Small organic molecule
Emp. Form.:
C25H34N4O4S
Mol. Mass.:
486.627
SMILES:
O=C(CC1CCCCC1)N1CCC(CC1)c1nc(no1)-c1ccc(cc1)S(=O)(=O)N1CCCC1
Structure:
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