Ligand 3-chlorocatechol

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Basic Ligand Information

Molecular Structure
Picture of 3-chlorocatechol (click for magnification)
Molecular Formula
BRENDA Name
InChIKey
C6H5ClO2
3-chlorocatechol
GQKDZDYQXPOXEM-UHFFFAOYSA-N
Synonyms:
2-chlorocatechol, 3-chloro-benzene-1,2-diol, 3-chlorobenzene-1,2-diol, 3-chloropyrocatechol

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Roles as Enzyme Ligand

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

EC NUMBER
PROVEN IN VIVO REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
2-chlorophenol + FADH2 + O2 = 2-chlorocatechol + FAD + H2O
show the reaction diagram
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Substrate in Enzyme-catalyzed Reactions (7 results)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE

Product in Enzyme-catalyzed Reactions (10 results)

EC NUMBER
REACTION
REACTION DIAGRAM
LITERATURE
ENZYME 3D STRUCTURE
2-chloronitrobenzene + NADH + O2 = 3-chlorocatechol + nitrite + NAD+
show the reaction diagram
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2-chlorophenol + NADPH + O2 = 3-chlorocatechol + NADP+ + H2O
show the reaction diagram
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o-chlorophenol + NADPH + O2 = 3-chloro-benzene-1,2-diol + NADP+ + H2O
show the reaction diagram
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2-chlorophenol + FADH2 + O2 = 2-chlorocatechol + FAD + H2O
show the reaction diagram
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3-chlorobenzene cis-dihydrodiol + NAD+ = 3-chlorocatechol + NADH + H+
show the reaction diagram
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cis-1,2-dihydrobenzene-3-chloro-(R,R)-1,2-diol + NAD+ = 3-chlorocatechol + NADH
show the reaction diagram
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Inhibitor in Enzyme-catalyzed Reactions (12 results)

EC NUMBER
COMMENTARY
LITERATURE
ENZYME 3D STRUCTURE
non-competitive inhibitor
-
the growth of strain BCG is retarded when the cultures are incubated either in the presence of 3-chlorocatechol on both solid and liquid media
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3D Structure of Enzyme-Ligand-Complex (PDB) (1 result)

EC NUMBER
ENZYME 3D STRUCTURE

Enzyme Kinetic Parameters

kcat Value (Turnover Number) (4 results)

EC NUMBER
TURNOVER NUMBER [1/S]
TURNOVER NUMBER MAXIMUM [1/S]
COMMENTARY
LITERATURE
0.18
-
in 50 mM Tris/HCl, pH 7.2, 25°C

KM Value (7 results)

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

Ki Value (7 results)

EC NUMBER
KI VALUE [MM]
KI VALUE MAXIMUM [MM]
COMMENTARY
LITERATURE
0.057
-
-
0.22
-
-
0.0067
-
pH and temperature not specified in the publication

References & Links

Links to other databases for 3-chlorocatechol

ChEBI
PubChem
ChEBI
PubChem