Ligand (S)-alpha-methylphenylacetic acid

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Basic Ligand Information

Molecular Structure
Picture of (S)-alpha-methylphenylacetic acid (click for magnification)
Molecular Formula
BRENDA Name
InChIKey
C9H10O2
(S)-alpha-methylphenylacetic acid
YPGCWEMNNLXISK-ZETCQYMHSA-N
Synonyms:
(2S)-2-phenylpropanoate, (2S)-2-phenylpropanoic acid, (S)-2-arylpropionic acid, (S)-2-phenylpropionate, (S)-2-phenylpropionic acid

Roles as Enzyme Ligand

In Vivo Substrate in Enzyme-catalyzed Reactions (1 result)

EC NUMBER
PROVEN IN VIVO REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
(S)-2-phenylpropionate = ?
show the reaction diagram
-

In Vivo Product in Enzyme-catalyzed Reactions (1 result)

EC NUMBER
PROVEN IN VIVO REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
2-arylpropionic amide + H2O = (S)-2-arylpropionic acid + NH3
show the reaction diagram
-

Substrate in Enzyme-catalyzed Reactions (1 result)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
(S)-2-phenylpropionate = ?
show the reaction diagram
-

Product in Enzyme-catalyzed Reactions (7 results)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
ethyl (2S)-2-phenylpropanoate + H2O = ethanol + (2S)-2-phenylpropanoate
show the reaction diagram
-
-
(R,S)-2-phenylpropionitrile + 2 H2O = (S)-2-phenylpropionic acid + NH3
show the reaction diagram
-
-
methyl(phenyl)propanedioic acid = (2S)-2-phenylpropanoic acid + CO2
show the reaction diagram
-
-

Inhibitor in Enzyme-catalyzed Reactions (2 results)

EC NUMBER
COMMENTARY
LITERATURE
ENZYME 3D STRUCTURE
IC50: 0.0057 mM
-

3D Structure of Enzyme-Ligand-Complex (PDB) (12 results)

Enzyme Kinetic Parameters

Ki Value (4 results)

EC NUMBER
KI VALUE [MM]
KI VALUE MAXIMUM [MM]
COMMENTARY
LITERATURE

IC50 Value (1 result)

EC NUMBER
IC50 VALUE
IC50 VALUE MAXIMUM
COMMENTARY
LITERATURE
0.0057
-
IC50: 0.0057 mM

References & Links

Links to other databases for (S)-alpha-methylphenylacetic acid

ChEBI
PubChem
ChEBI
PubChem