Literature summary for 1.3.1.9 extracted from

Freundlich, J.S.; Wang, F.; Tsai, H.C.; Kuo, M.; Shieh, H.M.; Anderson, J.W.; Nkrumah, L.J.; Valderramos, J.C.; Yu, M.; Kumar, T.R.; Valderramos, S.G.; Jacobs, W.R.; Schiehser, G.A.; Jacobus, D.P.; Fidock, D.A.; Sacchettini, J.C.
X-ray structural analysis of Plasmodium falciparum enoyl acyl carrier protein reductase as a pathway toward the optimization of triclosan antimalarial efficacy (2007), J. Biol. Chem., 282, 25436-25444.

Activating Compound

Activating Compound	Comment	Organism	Structure
manganese(III) diphosphate	activated through oxidation by manganese(III) diphosphate	Plasmodium falciparum

Crystallization (Commentary)

Crystallization (Comment)	Organism
in complex with isoniazid and NAD+, hanging drop vapour diffusion method in 2.4 M (NH4)2SO4, 0.1 M MES pH 5.6, at 16°C	Plasmodium falciparum

Inhibitors

Inhibitors	Comment	Organism
2-(2,4-dichlorophenoxy)-5-(2-ethylbutyl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-(2-methylbutyl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-(2-methylpropyl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-(2-phenylethyl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-(2H-tetrazol-5-yl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-(3-phenylpropyl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-(pyridin-2-ylmethyl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-(pyridin-3-ylmethyl)phenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-ethylphenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-methylphenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-propylphenol	-	Plasmodium falciparum
2-(2,4-dichlorophenoxy)-5-pyridin-3-ylphenol	-	Plasmodium falciparum
3-chloro-4-(2-hydroxy-4-pyridin-2-ylphenoxy)benzonitrile	-	Plasmodium falciparum
3-chloro-4-(2-hydroxy-4-pyridin-4-ylphenoxy)benzonitrile	-	Plasmodium falciparum
3-chloro-4-[(3-hydroxy-2'-methylbiphenyl-4-yl)oxy]benzonitrile	-	Plasmodium falciparum
3-chloro-4-[2-hydroxy-4-(pyridin-4-ylmethyl)phenoxy]benzonitrile	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)-2'-methylbiphenyl-3-ol	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)-3'-methylbiphenyl-3-ol	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)-3-hydroxybenzamide	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)-3-hydroxybenzoic acid	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)-3-hydroxybenzonitrile	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)-4'-fluorobiphenyl-3-ol	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)-4'-methylbiphenyl-3-ol	-	Plasmodium falciparum
4-(2,4-dichlorophenoxy)biphenyl-3-ol	-	Plasmodium falciparum
5-(cyclohexylmethyl)-2-(2,4-dichlorophenoxy)phenol	-	Plasmodium falciparum
5-benzyl-2-(2,4-dichlorophenoxy)phenol	-	Plasmodium falciparum
5-butyl-2-(2,4-dichlorophenoxy)phenol	-	Plasmodium falciparum
isoniazid	-	Plasmodium falciparum
triclosan	uncompetitive inhibitor	Plasmodium falciparum

Organism

Organism	UniProt	Comment	Textmining
Plasmodium falciparum	-	-	-

Purification (Commentary)

Purification (Comment)	Organism
-	Plasmodium falciparum

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
crotonyl-CoA + NADH + H+	-	Plasmodium falciparum	butyryl-CoA + NAD+	-	?

Synonyms

Synonyms	Comment	Organism
enoyl acyl carrier protein reductase	-	Plasmodium falciparum
ENR	-	Plasmodium falciparum
InhA	-	Plasmodium falciparum

Cofactor

Cofactor	Comment	Organism	Structure
NADH	-	Plasmodium falciparum

IC50 Value

IC50 Value	IC50 Value Maximum	Comment	Organism	Inhibitor
0.000038	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)-4'-fluorobiphenyl-3-ol
0.000049	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)-3-hydroxybenzonitrile
0.000071	-	-	Plasmodium falciparum	5-benzyl-2-(2,4-dichlorophenoxy)phenol
0.000073	-	-	Plasmodium falciparum	triclosan
0.000076	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(2-phenylethyl)phenol
0.00011	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-ethylphenol
0.00012	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(2-ethylbutyl)phenol
0.00014	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)biphenyl-3-ol
0.00018	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(2-methylpropyl)phenol
0.00019	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)-4'-methylbiphenyl-3-ol
0.0002	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-methylphenol
0.00021	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-propylphenol
0.00023	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)-3'-methylbiphenyl-3-ol
0.00029	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(2-methylbutyl)phenol
0.00041	-	-	Plasmodium falciparum	3-chloro-4-[(3-hydroxy-2'-methylbiphenyl-4-yl)oxy]benzonitrile
0.00044	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)-2'-methylbiphenyl-3-ol
0.00044	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(3-phenylpropyl)phenol
0.00048	-	-	Plasmodium falciparum	5-butyl-2-(2,4-dichlorophenoxy)phenol
0.00053	-	-	Plasmodium falciparum	3-chloro-4-[2-hydroxy-4-(pyridin-4-ylmethyl)phenoxy]benzonitrile
0.00053	-	-	Plasmodium falciparum	5-(cyclohexylmethyl)-2-(2,4-dichlorophenoxy)phenol
0.00064	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(pyridin-2-ylmethyl)phenol
0.0007	-	-	Plasmodium falciparum	3-chloro-4-(2-hydroxy-4-pyridin-2-ylphenoxy)benzonitrile
0.00084	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(pyridin-3-ylmethyl)phenol
0.0028	-	-	Plasmodium falciparum	3-chloro-4-(2-hydroxy-4-pyridin-4-ylphenoxy)benzonitrile
0.021	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)-3-hydroxybenzamide
0.033	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-pyridin-3-ylphenol
0.1	-	-	Plasmodium falciparum	4-(2,4-dichlorophenoxy)-3-hydroxybenzoic acid
0.1	-	-	Plasmodium falciparum	2-(2,4-dichlorophenoxy)-5-(2H-tetrazol-5-yl)phenol