Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetEnoyl-[acyl-carrier-protein] reductase [NADH]
LigandBDBM8726
Substrate/CompetitorBDBM16293
Meas. Tech.Enoyl-CoA Reductase Inhibition Assay
pH6.8±n/a
Temperature295.15±n/a K
IC50 1000±100 nM
Citation Sullivan, TJTruglio, JJBoyne, MENovichenok, PZhang, XStratton, CFLi, HJKaur, TAmin, AJohnson, FSlayden, RAKisker, CTonge, PJ High affinity InhA inhibitors with activity against drug-resistant strains of Mycobacterium tuberculosis. ACS Chem Biol1:43-53 (2006) [PubMed]  Article
More Info.:Get all data from this article,  Inhibition_Run data,   Solution Info,  Assay Method
 
Enoyl-[acyl-carrier-protein] reductase [NADH]
Name:Enoyl-[acyl-carrier-protein] reductase [NADH]
Synonyms:Enoyl-ACP Reductase (InhA) | Enoyl-[acyl-carrier-protein] reductase | Enoyl-[acyl-carrier-protein] reductase [NADH] | INHA_MYCTU | NADH-dependent enoyl-ACP reductase | inhA
Type:Enzyme
Mol. Mass.:28526.00
Organism:Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Description:P9WGR1
Residue:269
Sequence:
MTGLLDGKRILVSGIITDSSIAFHIARVAQEQGAQLVLTGFDRLRLIQRITDRLPAKAPL
LELDVQNEEHLASLAGRVTEAIGAGNKLDGVVHSIGFMPQTGMGINPFFDAPYADVSKGI
HISAYSYASMAKALLPIMNPGGSIVGMDFDPSRAMPAYNWMTVAKSALESVNRFVAREAG
KYGVRSNLVAAGPIRTLAMSAIVGGALGEEAGAQIQLLEEGWDQRAPIGWNMKDATPVAK
TVCALLSDWLPATTGDIIYADGGAHTQLL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM8726
BDBM16293
NameBDBM8726
Synonyms:5-chloro-2-(2,4-dichlorophenoxy)phenol | CHEMBL849 | TCL | Triclosan | US20230414581, Compound 35
TypeSmall organic molecule
Emp. Form.C12H7Cl3O2
Mol. Mass.289.542
SMILESOc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: