Ligand Mandelate

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Basic Ligand Information

Molecular Structure
Picture of Mandelate (click for magnification)
Molecular Formula
BRENDA Name
InChIKey
C8H8O3
Mandelate
IWYDHOAUDWTVEP-UHFFFAOYSA-N
Synonyms:
(+)-mandelate, (-)-mandelate, (R,S)-mandelate, 2-hydroxy-2-phenylacetate, D,L-Mandelate, DL-alpha-hydroxyphenylacetic acid, DL-mandelate, DL-[2-1H]-mandelate, DL-[2-2H]-mandelate, hydroxy(phenyl)acetate, hydroxy(phenyl)acetic acid, Mandelic acid

Roles as Enzyme Ligand

In Vivo Product in Enzyme-catalyzed Reactions (2 results)

EC NUMBER
PROVEN IN VIVO REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE

Substrate in Enzyme-catalyzed Reactions (17 results)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
2-hydroxy-2-phenylacetate + O2 = phenylpyruvate + H2O2
show the reaction diagram
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mandelate + oxidized acceptor = oxo(phenyl)acetic acid + reduced acceptor
show the reaction diagram
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DL-mandelate + O2 = ?
show the reaction diagram
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mandelic acid + H2O + O2 = phenylpyruvate + NH3 + H2O2
show the reaction diagram
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UDP-glucose + mandelic acid = ?
show the reaction diagram
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mandelic acid + H2O = ?
show the reaction diagram
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mandelate = ?
show the reaction diagram
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Product in Enzyme-catalyzed Reactions (25 results)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
phenylglyoxylate + NADH + H+ = hydroxy(phenyl)acetic acid + NAD+
show the reaction diagram
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(S)-mandelate + ferricytochrome c = hydroxy(phenyl)acetate + ferrocytochrome c
show the reaction diagram
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methyl mandelate + H2O = methanol + mandelate
show the reaction diagram
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DL-alpha-hydroxybenzylpenicillin + H2O = 6-aminopenicillanate + DL-alpha-hydroxyphenylacetic acid
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mandelamine + H2O = mandelic acid + NH3
show the reaction diagram
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mandelamide + H2O = mandelic acid + NH3
show the reaction diagram
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R,S-mandelamide + H2O = mandelic acid + ammonia
show the reaction diagram
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mandelonitrile + 2 H2O = mandelic acid + NH3
show the reaction diagram
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hydroxy(phenyl)propanedioic acid + H+ = hydroxy(phenyl)acetic acid + CO2
show the reaction diagram
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Activator in Enzyme-catalyzed Reactions (1 result)

EC NUMBER
COMMENTARY
LITERATURE
ENZYME 3D STRUCTURE
110% activity at 0.5 mM
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Inhibitor in Enzyme-catalyzed Reactions (7 results)

EC NUMBER
COMMENTARY
LITERATURE
ENZYME 3D STRUCTURE
competitive
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weak inhibition
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85% residual activity at 0.5 mM
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Enzyme Kinetic Parameters

kcat Value (Turnover Number) (15 results)

EC NUMBER
TURNOVER NUMBER [1/S]
TURNOVER NUMBER MAXIMUM [1/S]
COMMENTARY
LITERATURE

KM Value (16 results)

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

Ki Value (2 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
3.7
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References & Links

Links to other databases for Mandelate

ChEBI
PubChem
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PubChem