Ligand ethyl acetate

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Basic Ligand Information

Molecular Structure
Picture of ethyl acetate (click for magnification)
Molecular Formula
BRENDA Name
InChIKey
C4H8O2
ethyl acetate
XEKOWRVHYACXOJ-UHFFFAOYSA-N
Synonyms:
acetic acid ethyl ester, EtOAc

Show all pahtways known for Show all pathways known for ethyl acetate

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
ethyl acetate + H2O = ethanol + acetate
show the reaction diagram
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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 (10 results)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
ethyl acetate + H2O = ethanol + acetate
show the reaction diagram
ethyl acetate + H2O = ethanol + acetate
show the reaction diagram
deacetyl-7-aminocephalosporanic acid + ethyl acetate = 7-aminocephalosporanic acid + ethanol
show the reaction diagram
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ethyl acetate + H2O = ethanol + acetate
show the reaction diagram
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ethyl acetate + H2O = ethanol + acetate
show the reaction diagram
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ethyl acetate + H2O = ?
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Product in Enzyme-catalyzed Reactions (6 results)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
2-butanone + NADPH + H+ + O2 = ethyl acetate + NADP+ + H2O
show the reaction diagram
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cyanoacetic acid ethyl ester + H2O = acetic acid ethyl ester + NH3
show the reaction diagram
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Activator in Enzyme-catalyzed Reactions (4 results)

EC NUMBER
COMMENTARY
LITERATURE
ENZYME 3D STRUCTURE
wild-type, 21% increase of activity
-
98% activation of recombinant refolded enzyme at 30% v/v
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20%, 171% activation
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enhances the enzyme activity up to 4fold upon permeabilization
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Inhibitor in Enzyme-catalyzed Reactions (13 results)

EC NUMBER
COMMENTARY
LITERATURE
ENZYME 3D STRUCTURE
noncompetitively with respect to NADP+ and (S)-ethyl 3-hydroxybutyrate at backward reaction
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complete inhibition in buffer without NaCl, 67% inhibition in buffer with 600 mM NaCl
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the native enzyme shows less than 5% residual activity in the presence of ethyl acetate
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19% residual activity after 30 min incubation at 30% (v/v)
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inhibitory at 8% (v/v)
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85.29% residual activity at 0.5 mM
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at 12.5% (v/v) remaining activity, 71.96%, and 25% (v/v) remaining activity, 41.62%
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3D Structure of Enzyme-Ligand-Complex (PDB) (4 results)

Enzyme Kinetic Parameters

kcat Value (Turnover Number) (2 results)

EC NUMBER
TURNOVER NUMBER [1/S]
TURNOVER NUMBER MAXIMUM [1/S]
COMMENTARY
LITERATURE
0.242
-
-
0.24
-
pH 8.0, genetic variant PON1 G2E6

KM Value (5 results)

EC NUMBER
KM VALUE [MM]
KM VALUE MAXIMUM [MM]
COMMENTARY
LITERATURE
15.4
-
-
0.36
-
-
18
-
-

References & Links

Links to other databases for ethyl acetate

ChEBI
PubChem
ChEBI
PubChem