Crystallization (Comment) | Organism |
---|---|
docking experiments with the soluble squash chloroplast enzyme crystal structure, PDB code 1k30, and inhibitors (1S,2R,3R)-2-hydroxy-3-[(octylsulfonyl)amino]cyclopentanecarboxylic acid, (+-)-2-hydroxy-3-(octylsulfonamido)-cyclohexanecarboxylic acid, (1S,2S,3S)-2-hydroxy-3-[(octylsulfonyl)amino]cyclopentanecarboxylic acid, and (+-)-2-(2-hydroxy-3-(octylsulfonamido)-cyclopentyl)acetic acid. Cyclopentyl and cyclohexyl scaffolds of the inhibitors may be occluded from the enzyme active site by two protein loops that sterically guard the phosphate binding region | Cucurbita moschata |
Inhibitors | Comment | Organism | Structure |
---|---|---|---|
(+-)-2-(2-hydroxy-3-(octylsulfonamido)-cyclopentyl)acetic acid | - |
Cucurbita moschata | |
(+-)-2-(2-hydroxy-3-(octylsulfonamido)-cyclopentyl)acetic acid | 8% inhibition at 40 microg/ml | Homo sapiens | |
(+-)-2-hydroxy-3-(octylsulfonamido)-cyclohexanecarboxylic acid | - |
Cucurbita moschata | |
(+-)-2-hydroxy-3-(octylsulfonamido)-cyclohexanecarboxylic acid | 36% inhibition at 40 microg/ml | Homo sapiens | |
(+-)-2-hydroxy-3-(octylsulfonamido)-cyclopentane carboxylic acid | 97% inhibition at 40 microg/ml | Homo sapiens | |
(+-)-2-hydroxy-3-(octylsulfonamido)-cyclopentanecarboxylic acid | 3% inhibition at 40 microg/ml | Homo sapiens | |
(1S,2R,3R)-2-hydroxy-3-[(octylsulfonyl)amino]cyclopentanecarboxylic acid | - |
Cucurbita moschata | |
(1S,2S,3S)-2-hydroxy-3-[(octylsulfonyl)amino]cyclopentanecarboxylic acid | - |
Cucurbita moschata | |
2-(nonylsulfonamido)benzoic acid | - |
Cucurbita moschata | |
2-(nonylsulfonamido)benzoic acid | 97% inhibition at 40 microg/ml | Homo sapiens | |
additional information | cyclopentyl and cyclohexyl scaffolds may be occluded from the enzyme active site by two protein loops that sterically guard the phosphate binding region | Homo sapiens |
Organism | UniProt | Comment | Textmining |
---|---|---|---|
Cucurbita moschata | P10349 | - |
- |
Homo sapiens | - |
- |
- |
Source Tissue | Comment | Organism | Textmining |
---|
Substrates | Comment Substrates | Organism | Products | Comment (Products) | Rev. | Reac. |
---|---|---|---|---|---|---|
glycerol 3-phosphate + palmitoyl-CoA | - |
Homo sapiens | CoA + 1-palmitoyl-sn-glycerol 3-phosphate | - |
? | |
glycerol 3-phosphate + palmitoyl-CoA | - |
Cucurbita moschata | CoA + 1-palmitoyl-sn-glycerol 3-phosphate | - |
? |
IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
---|---|---|---|---|---|
0.0247 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | 2-(nonylsulfonamido)benzoic acid | |
0.164 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | (+-)-2-hydroxy-3-(octylsulfonamido)-cyclohexanecarboxylic acid | |
0.255 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | (+-)-2-hydroxy-3-(octylsulfonamido)-cyclopentane carboxylic acid | |
0.295 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | (+-)-2-(2-hydroxy-3-(octylsulfonamido)-cyclopentyl)acetic acid | |
0.324 | - |
pH not specified in the publication, temperature not specified in the publication | Homo sapiens | (+-)-2-hydroxy-3-(octylsulfonamido)-cyclopentanecarboxylic acid |