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Literature summary for 1.3.1.9 extracted from

  • Belluti, F.; Perozzo, R.; Lauciello, L.; Colizzi, F.; Kostrewa, D.; Bisi, A.; Gobbi, S.; Rampa, A.; Bolognesi, M.L.; Recanatini, M.; Brun, R.; Scapozza, L.; Cavalli, A.
    Design, synthesis, and biological and crystallographic evaluation of novel inhibitors of Plasmodium falciparum enoyl-ACP-reductase (PfFabI) (2013), J. Med. Chem., 56, 7516-7526.
    View publication on PubMed

Cloned(Commentary)

Cloned (Comment) Organism
-
Plasmodium falciparum

Crystallization (Commentary)

Crystallization (Comment) Organism
in complex with NADH and inhibitors, hanging drop vapor diffusion method Plasmodium falciparum

Inhibitors

Inhibitors Comment Organism Structure
3-(4-(4-chloro-2-hydroxyphenoxy)phenyl)-7-hydroxy-2H-chromen-2-one
-
Plasmodium falciparum
3-(4-chloro-2-hydroxyphenoxy)-4-methyl-2H-chromen-2-one
-
Plasmodium falciparum
3-(4-chloro-2-hydroxyphenoxy)-5,7-dihydroxy-2H-chromen-2-one
-
Plasmodium falciparum
3-(4-chloro-2-hydroxyphenoxy)-6-hydroxy-2H-chromen-2-one
-
Plasmodium falciparum
3-(4-chloro-2-hydroxyphenoxy)-7-hydroxy-2H-chromen-2-one
-
Plasmodium falciparum
3-(4-chloro-2-hydroxyphenoxy)-7-hydroxy-4-methyl-2H-chromen-2-one
-
Plasmodium falciparum
6-(4-chloro-2-hydroxyphenoxy)-2H-chromen-2-one
-
Plasmodium falciparum
6-(4-chloro-2-hydroxyphenoxy)-4-ethyl-2H-chromen-2-one
-
Plasmodium falciparum
6-(4-chloro-2-hydroxyphenoxy)-4-methyl-2H-chromen-2-one
-
Plasmodium falciparum
6-(4-chloro-2-hydroxyphenoxy)naphthalen-2-ol
-
Plasmodium falciparum
7-(4-chloro-2-hydroxyphenoxy)-2H-chromen-2-one
-
Plasmodium falciparum
7-(4-chloro-2-hydroxyphenoxy)-4-ethyl-2H-chromen-2-one
-
Plasmodium falciparum
7-(4-chloro-2-hydroxyphenoxy)-4-methyl-2H-chromen-2-one
-
Plasmodium falciparum
additional information not inhibited by (-)-epigallocatechin gallate, chloroquine, and podophyllotoxin Plasmodium falciparum
triclosan i.e. 5-chloro-2-(2,4-dichlorophenoxy)phenol Plasmodium falciparum

Natural Substrates/ Products (Substrates)

Natural Substrates Organism Comment (Nat. Sub.) Natural Products Comment (Nat. Pro.) Rev. Reac.
trans-2-enoyl-[acyl-carrier protein] + NADH + H+ Plasmodium falciparum
-
acyl-[acyl-carrier protein] + NAD+
-
?

Organism

Organism UniProt Comment Textmining
Plasmodium falciparum C6KSZ2
-
-

Purification (Commentary)

Purification (Comment) Organism
-
Plasmodium falciparum

Substrates and Products (Substrate)

Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
trans-2-enoyl-[acyl-carrier protein] + NADH + H+
-
Plasmodium falciparum acyl-[acyl-carrier protein] + NAD+
-
?

Synonyms

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

Cofactor

Cofactor Comment Organism Structure
NADH
-
Plasmodium falciparum

IC50 Value

IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
0.00005
-
pH and temperature not specified in the publication Plasmodium falciparum triclosan