EC Number | Application | Comment | Organism |
---|---|---|---|
2.3.1.180 | drug development | the highly conserved enzyme is an attractive target for antimicrobial inhibitor design | Enterococcus faecalis |
EC Number | Crystallization (Comment) | Organism |
---|---|---|
2.3.1.180 | purified recombinant free enzyme, hanging drop vapour diffusion method, 20 mg/ml protein at 15°C with 0.2 M lithium sulfate, 0.1 M Bis-Tris, pH 6.5, 25% PEG 3350, enzyme mutant D36A/E37A with 2-[4-(3,5-dimethylpiperidin-1-yl)-3-phenoxybenzoylamino]benzoic acid, in 25% PEG 3350, 0.2 M ammonium sulfate, and 0.1 M Bis-Tris, pH 5.5, X-ray diffraction structure determination and analysis at 1.8 A resolution | Enterococcus faecalis |
EC Number | Inhibitors | Comment | Organism | Structure |
---|---|---|---|---|
2.3.1.180 | 14-bromo-3-diethylsulfamoyl-5-methylbenzoic acid | - |
Enterococcus faecalis | |
2.3.1.180 | 2-(3-bromobenzoylamino)benzoic acid methyl ester | - |
Enterococcus faecalis | |
2.3.1.180 | 2-(3-diethylsulfamoyl-4-fluorobenzoylamino)benzoic acid | IC50 is 0.0084 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-diethylsulfamoyl-4-methoxybenzoylamino)benzoic acid | IC50 is 0.0114 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-diethylsulfamoyl-4-phenoxybenzoylamino)benzoic acid | IC50 is 0.0061 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-diethylsulfamoyl-4-piperidin-1-ylbenzoylamino)benzoic acid | IC50 is 0.0022 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-phenoxy-4-piperazin-1-ylbenzoylamino)benzoic acid | IC50 is 0.185 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-phenoxy-4-piperidin-1-ylbenzoylamino)benzoic acid | IC50 is 0.00029 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-phenoxy-4-pyridin-3-ylbenzoylamino)benzoic acid | IC50 is 0.00011 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-phenoxy-4-thiomorpholin-4-ylbenzoylamino)benzoic acid | IC50 is 0.0012 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-phenoxybenzoylamino)benzoic acid | IC50 is 0.0027 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-phenoxybenzoylamino)nicotinic acid | IC50 is above 1.0 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(3-phenoxybenzoylamino)thiophene-3-carboxylic acid | IC50 is 0.043 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(4-bromo-3-diethylsulfamoyl-5-methylbenzoylamino)-benzoic acid | IC50 is 0.16 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(4-bromo-3-diethylsulfamoylbenzoylamino)-benzoic acid | IC50 is 0.0016 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(4-bromo-3-phenoxybenzoylamino)-6-hydroxybenzoic acid | IC50 is 0.000062 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(4-bromo-3-phenoxybenzoylamino)-6-methoxybenzoic acid | - |
Enterococcus faecalis | |
2.3.1.180 | 2-(4-bromo-3-phenoxybenzoylamino)benzoic acid | IC50 is 0.0011 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(4-bromo-3-phenoxybenzoylamino)benzoic acid methyl ester | - |
Enterococcus faecalis | |
2.3.1.180 | 2-(4-cyclopentylmethoxy-3-diethylsulfamoylbenzoylamino)benzoic acid | IC50 is 0.0021 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(4-fluoro-3-phenoxybenzoylamino)benzoic acid | IC50 is 0.0038 mM | Enterococcus faecalis | |
2.3.1.180 | 2-(4-fluoro-3-phenoxybenzoylamino)benzoic acid methyl ester | - |
Enterococcus faecalis | |
2.3.1.180 | 2-(4-morpholin-4-yl-3-phenoxybenzoylamino)benzoic acid | IC50 is 0.0032 mM | Enterococcus faecalis | |
2.3.1.180 | 2-fluoro-6-(3-phenoxybenzoylamino)benzoic acid | IC50 is 0.006 mM | Enterococcus faecalis | |
2.3.1.180 | 2-hydroxy-6-(3-phenoxybenzoylamino)benzoic acid | IC50 is 0.00041 mM | Enterococcus faecalis | |
2.3.1.180 | 2-hydroxy-6-[(2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.000004 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(2',4'-difluoro-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00016 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(2-diethylsulfamoyl-biphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.0016 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(2-phenoxy-3'-trifluoromethoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00047 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(2-phenoxy-4'-trifluoromethylbiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.000096 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.000056 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(3',4'-difluoro-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00033 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(3'-chloro-4'-fluoro-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00057 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(3'-isopropyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00079 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(4'-chloro-3'-methyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00025 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(4'-ethoxy-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00022 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(4'-fluoro-3'-methyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00024 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(4'-hydroxy-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00041 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(4'-methanesulfonyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.000028 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[(4'-methyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | IC50 is 0.00016 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[3-(3-carboxyphenoxy)benzoylamino]benzoic acid | IC50 is 0.0037 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[3-(4-carboxyphenoxy)benzoylamino]benzoic acid | IC50 is 0.0044 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[3-(4-fluorophenoxy)benzoylamino]benzoic acid | IC50 is 0.005 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[3-(pyridin-4-yloxy)benzoylamino]benzoic acid | IC50 is 0.010 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[3-phenoxy-4-(1H-pyrazol-4-yl)benzoylamino]benzoic acid | IC50 is 0.022 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[4-(3,5-dimethylpiperazin-1-yl)-3-phenoxybenzoylamino]benzoic acid | IC50 is 0.038 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[4-(3,5-dimethylpiperidin-1-yl)-3-phenoxybenzoylamino]benzoic acid | IC50 is 0.00027 mM | Enterococcus faecalis | |
2.3.1.180 | 2-[4-(4-methylpiperazin-1-yl)-3-phenoxybenzoylamino]benzoic acid | IC50 is 0.025 mM | Enterococcus faecalis | |
2.3.1.180 | 3-(3-phenoxybenzoylamino)pyridine-2-carboxylic acid | IC50 is 0.290 mM | Enterococcus faecalis | |
2.3.1.180 | 3-(3-phenoxybenzoylamino)thiophene-2-carboxylic acid | IC50 is 0.0101 mM | Enterococcus faecalis | |
2.3.1.180 | 3-diethylsulfamoyl-4-fluorobenzoic acid | - |
Enterococcus faecalis | |
2.3.1.180 | 3-diethylsulfamoyl-4-methoxybenzoic acid | - |
Enterococcus faecalis | |
2.3.1.180 | 4'-(2-carboxyphenylcarbamoyl)-2'-phenoxybiphenyl-4-carboxylic acid | IC50 is 0.0021 mM | Enterococcus faecalis | |
2.3.1.180 | 4-bromo-3-diethylsulfamoylbenzoic acid | - |
Enterococcus faecalis | |
2.3.1.180 | 4-bromo-3-phenoxybenzoic acid | - |
Enterococcus faecalis | |
2.3.1.180 | 4-fluoro-3-phenoxybenzoic acid | - |
Enterococcus faecalis | |
2.3.1.180 | methyl 4-bromo-3-hydroxybenzoate | - |
Enterococcus faecalis | |
2.3.1.180 | additional information | inhibitor design by computational chemistry, antibacterial potency of inhibitors, overview | Enterococcus faecalis | |
2.3.1.180 | pyridin-4-yloxybenzoic acid | - |
Enterococcus faecalis |
EC Number | Natural Substrates | Organism | Comment (Nat. Sub.) | Natural Products | Comment (Nat. Pro.) | Rev. | Reac. |
---|---|---|---|---|---|---|---|
2.3.1.180 | acetyl-CoA + malonyl-[acyl-carrier protein] | Enterococcus faecalis | the enzyme initiates the fatty acid biosynthesis | acetoacetyl-[acyl-carrier protein] + CoA + CO2 | - |
? |
EC Number | Organism | UniProt | Comment | Textmining |
---|---|---|---|---|
2.3.1.180 | Enterococcus faecalis | - |
- |
- |
EC Number | Substrates | Comment Substrates | Organism | Products | Comment (Products) | Rev. | Reac. |
---|---|---|---|---|---|---|---|
2.3.1.180 | acetyl-CoA + malonyl-[acyl-carrier protein] | - |
Enterococcus faecalis | acetoacetyl-[acyl-carrier protein] + CoA + CO2 | - |
? | |
2.3.1.180 | acetyl-CoA + malonyl-[acyl-carrier protein] | the enzyme initiates the fatty acid biosynthesis | Enterococcus faecalis | acetoacetyl-[acyl-carrier protein] + CoA + CO2 | - |
? |
EC Number | Synonyms | Comment | Organism |
---|---|---|---|
2.3.1.180 | beta-ketoacyl-ACP synthase III | - |
Enterococcus faecalis |
2.3.1.180 | beta-ketoacyl-acyl carrier protein synthase III | - |
Enterococcus faecalis |
EC Number | pH Optimum Minimum | pH Optimum Maximum | Comment | Organism |
---|---|---|---|---|
2.3.1.180 | 7 | - |
assay at | Enterococcus faecalis |
EC Number | IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
---|---|---|---|---|---|---|
2.3.1.180 | 0.000004 | - |
IC50 is 0.000004 mM | Enterococcus faecalis | 2-hydroxy-6-[(2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.000028 | - |
IC50 is 0.000028 mM | Enterococcus faecalis | 2-[(4'-methanesulfonyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.000056 | - |
IC50 is 0.000056 mM | Enterococcus faecalis | 2-[(2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.000062 | - |
IC50 is 0.000062 mM | Enterococcus faecalis | 2-(4-bromo-3-phenoxybenzoylamino)-6-hydroxybenzoic acid | |
2.3.1.180 | 0.000096 | - |
IC50 is 0.000096 mM | Enterococcus faecalis | 2-[(2-phenoxy-4'-trifluoromethylbiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00011 | - |
IC50 is 0.00011 mM | Enterococcus faecalis | 2-(3-phenoxy-4-pyridin-3-ylbenzoylamino)benzoic acid | |
2.3.1.180 | 0.00016 | - |
IC50 is 0.00016 mM | Enterococcus faecalis | 2-[(4'-methyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00016 | - |
IC50 is 0.00016 mM | Enterococcus faecalis | 2-[(2',4'-difluoro-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00022 | - |
IC50 is 0.00022 mM | Enterococcus faecalis | 2-[(4'-ethoxy-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00024 | - |
IC50 is 0.00024 mM | Enterococcus faecalis | 2-[(4'-fluoro-3'-methyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00025 | - |
IC50 is 0.00025 mM | Enterococcus faecalis | 2-[(4'-chloro-3'-methyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00027 | - |
IC50 is 0.00027 mM | Enterococcus faecalis | 2-[4-(3,5-dimethylpiperidin-1-yl)-3-phenoxybenzoylamino]benzoic acid | |
2.3.1.180 | 0.00029 | - |
IC50 is 0.00029 mM | Enterococcus faecalis | 2-(3-phenoxy-4-piperidin-1-ylbenzoylamino)benzoic acid | |
2.3.1.180 | 0.00033 | - |
IC50 is 0.00033 mM | Enterococcus faecalis | 2-[(3',4'-difluoro-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00041 | - |
IC50 is 0.00041 mM | Enterococcus faecalis | 2-[(4'-hydroxy-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00041 | - |
IC50 is 0.00041 mM | Enterococcus faecalis | 2-hydroxy-6-(3-phenoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.00047 | - |
IC50 is 0.00047 mM | Enterococcus faecalis | 2-[(2-phenoxy-3'-trifluoromethoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00057 | - |
IC50 is 0.00057 mM | Enterococcus faecalis | 2-[(3'-chloro-4'-fluoro-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.00079 | - |
IC50 is 0.00079 mM | Enterococcus faecalis | 2-[(3'-isopropyl-2-phenoxybiphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.0011 | - |
IC50 is 0.0011 mM | Enterococcus faecalis | 2-(4-bromo-3-phenoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.0012 | - |
IC50 is 0.0012 mM | Enterococcus faecalis | 2-(3-phenoxy-4-thiomorpholin-4-ylbenzoylamino)benzoic acid | |
2.3.1.180 | 0.0016 | - |
IC50 is 0.0016 mM | Enterococcus faecalis | 2-(4-bromo-3-diethylsulfamoylbenzoylamino)-benzoic acid | |
2.3.1.180 | 0.0016 | - |
IC50 is 0.0016 mM | Enterococcus faecalis | 2-[(2-diethylsulfamoyl-biphenyl-4-carbonyl)amino]benzoic acid | |
2.3.1.180 | 0.0021 | - |
IC50 is 0.0021 mM | Enterococcus faecalis | 2-(4-cyclopentylmethoxy-3-diethylsulfamoylbenzoylamino)benzoic acid | |
2.3.1.180 | 0.0021 | - |
IC50 is 0.0021 mM | Enterococcus faecalis | 4'-(2-carboxyphenylcarbamoyl)-2'-phenoxybiphenyl-4-carboxylic acid | |
2.3.1.180 | 0.0022 | - |
IC50 is 0.0022 mM | Enterococcus faecalis | 2-(3-diethylsulfamoyl-4-piperidin-1-ylbenzoylamino)benzoic acid | |
2.3.1.180 | 0.0027 | - |
IC50 is 0.0027 mM | Enterococcus faecalis | 2-(3-phenoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.0032 | - |
IC50 is 0.0032 mM | Enterococcus faecalis | 2-(4-morpholin-4-yl-3-phenoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.0037 | - |
IC50 is 0.0037 mM | Enterococcus faecalis | 2-[3-(3-carboxyphenoxy)benzoylamino]benzoic acid | |
2.3.1.180 | 0.0038 | - |
IC50 is 0.0038 mM | Enterococcus faecalis | 2-(4-fluoro-3-phenoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.0044 | - |
IC50 is 0.0044 mM | Enterococcus faecalis | 2-[3-(4-carboxyphenoxy)benzoylamino]benzoic acid | |
2.3.1.180 | 0.005 | - |
IC50 is 0.005 mM | Enterococcus faecalis | 2-[3-(4-fluorophenoxy)benzoylamino]benzoic acid | |
2.3.1.180 | 0.006 | - |
IC50 is 0.006 mM | Enterococcus faecalis | 2-fluoro-6-(3-phenoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.0061 | - |
IC50 is 0.0061 mM | Enterococcus faecalis | 2-(3-diethylsulfamoyl-4-phenoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.0084 | - |
IC50 is 0.0084 mM | Enterococcus faecalis | 2-(3-diethylsulfamoyl-4-fluorobenzoylamino)benzoic acid | |
2.3.1.180 | 0.01 | - |
IC50 is 0.010 mM | Enterococcus faecalis | 2-[3-(pyridin-4-yloxy)benzoylamino]benzoic acid | |
2.3.1.180 | 0.0101 | - |
IC50 is 0.0101 mM | Enterococcus faecalis | 3-(3-phenoxybenzoylamino)thiophene-2-carboxylic acid | |
2.3.1.180 | 0.0114 | - |
IC50 is 0.0114 mM | Enterococcus faecalis | 2-(3-diethylsulfamoyl-4-methoxybenzoylamino)benzoic acid | |
2.3.1.180 | 0.022 | - |
IC50 is 0.022 mM | Enterococcus faecalis | 2-[3-phenoxy-4-(1H-pyrazol-4-yl)benzoylamino]benzoic acid | |
2.3.1.180 | 0.025 | - |
IC50 is 0.025 mM | Enterococcus faecalis | 2-[4-(4-methylpiperazin-1-yl)-3-phenoxybenzoylamino]benzoic acid | |
2.3.1.180 | 0.038 | - |
IC50 is 0.038 mM | Enterococcus faecalis | 2-[4-(3,5-dimethylpiperazin-1-yl)-3-phenoxybenzoylamino]benzoic acid | |
2.3.1.180 | 0.043 | - |
IC50 is 0.043 mM | Enterococcus faecalis | 2-(3-phenoxybenzoylamino)thiophene-3-carboxylic acid | |
2.3.1.180 | 0.16 | - |
IC50 is 0.16 mM | Enterococcus faecalis | 2-(4-bromo-3-diethylsulfamoyl-5-methylbenzoylamino)-benzoic acid | |
2.3.1.180 | 0.185 | - |
IC50 is 0.185 mM | Enterococcus faecalis | 2-(3-phenoxy-4-piperazin-1-ylbenzoylamino)benzoic acid | |
2.3.1.180 | 0.29 | - |
IC50 is 0.290 mM | Enterococcus faecalis | 3-(3-phenoxybenzoylamino)pyridine-2-carboxylic acid | |
2.3.1.180 | 1 | - |
IC50 is above 1.0 mM | Enterococcus faecalis | 2-(3-phenoxybenzoylamino)nicotinic acid |