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Literature summary extracted from

  • Alhamadsheh, M.M.; Musayev, F.; Komissarov, A.A.; Sachdeva, S.; Wright, H.T.; Scarsdale, N.; Florova, G.; Reynolds, K.A.
    Alkyl-CoA disulfides as inhibitors and mechanistic probes for FabH enzymes (2007), Chem. Biol., 14, 513-524.
    View publication on PubMed

Crystallization (Commentary)

EC Number Crystallization (Comment) Organism
2.3.1.180 cyrstals of ecFabH and the ecFabH/methyl-CoA disulfide complex are obtained by the hanging drop method Escherichia coli
2.3.1.301 enzyme in complex with inhibitor CoA methyldisulfide Mycobacterium tuberculosis

Inhibitors

EC Number Inhibitors Comment Organism Structure
2.3.1.180 decyl-CoA disulfide
-
 Mycobacterium tuberculosis
2.3.1.180 methyl-CoA disulfide
-
 Escherichia coli
2.3.1.180 additional information no significant inhibitory activity at 0.3 mM: butyl-CoA disulfide, sec-butyl-CoA disulfide, octyl-CoA disulfide, decyl-CoA disulfide Escherichia coli
2.3.1.180 additional information no significant inhibitory activity at 0.3 mM: methyl-CoA disulfide, butyl-CoA disulfide, sec-butyl-CoA disulfide Mycobacterium tuberculosis
2.3.1.180 octyl-CoA disulfide
-
 Mycobacterium tuberculosis
2.3.1.301 CoA decyldisulfide
-
 Mycobacterium tuberculosis
2.3.1.301 CoA octyldisulfide
-
 Mycobacterium tuberculosis

Organism

EC Number Organism UniProt Comment Textmining
2.3.1.180 Escherichia coli
-
-
-
2.3.1.180 Mycobacterium tuberculosis
-
-
-
2.3.1.301 Mycobacterium tuberculosis P9WNG3
-
-
2.3.1.301 Mycobacterium tuberculosis H37Rv P9WNG3
-
-

Substrates and Products (Substrate)

EC Number Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
2.3.1.180 acetyl-CoA + malonyl-[acyl-carrier protein]
-
 Escherichia coli acetoacetyl-[acyl-carrier protein] + CoA + CO2
-
 ?
2.3.1.180 acetyl-CoA + malonyl-[acyl-carrier protein]
-
 Mycobacterium tuberculosis acetoacetyl-[acyl-carrier protein] + CoA + CO2
-
 ?

Synonyms

EC Number Synonyms Comment Organism
2.3.1.180 ecFabH
-
 Escherichia coli
2.3.1.180 FabH
-
 Mycobacterium tuberculosis
2.3.1.301 FabH
-
 Mycobacterium tuberculosis

IC50 Value

EC Number IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
2.3.1.180 0.0012
-
-
 Mycobacterium tuberculosis decyl-CoA disulfide
2.3.1.180 0.0301
-
-
 Mycobacterium tuberculosis octyl-CoA disulfide
2.3.1.180 0.0571
-
-
 Escherichia coli methyl-CoA disulfide
2.3.1.301 0.0012
-
 pH 7.4, 23°C Mycobacterium tuberculosis CoA decyldisulfide
2.3.1.301 0.0301
-
 pH 7.4, 23°C Mycobacterium tuberculosis CoA octyldisulfide