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Literature summary extracted from

  • Geduhn, J.; Dove, S.; Shen, Y.; Tang, W.J.; Koenig, B.; Seifert, R.
    Bis-halogen-anthraniloyl-substituted nucleoside 5-triphosphates as potent and selective inhibitors of Bordetella pertussis adenylyl cyclase toxin (2011), J. Pharmacol. Exp. Ther., 336, 104-115.
    View publication on PubMedView publication on EuropePMC

Cloned(Commentary)

EC Number Cloned (Comment) Organism
4.6.1.1 expressed in Sf9 insect cells Bordetella pertussis

Inhibitors

EC Number Inhibitors Comment Organism Structure
4.6.1.1 2',3'-O-bis(5-acetamidoanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-bromoanthraniloyl)-ADP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-bromoanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-bromoanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-chloroanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-chloroanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-methylanthraniloyl)-ADP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-methylanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-methylanthraniloyl)-CTP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-methylanthraniloyl)-IDP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-methylanthraniloyl)-IMP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-methylanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-propylanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis(5-propylanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 2',3'-O-bis-anthraniloyl-IMP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-acetamidoanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-acetamidoanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-bromoanthraniloyl)-ADP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-bromoanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-bromoanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-chloroanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-chloroanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-propylanthraniloyl)-ATP
-
 Bordetella pertussis
4.6.1.1 3'-O-(5-propylanthraniloyl)-ITP
-
 Bordetella pertussis
4.6.1.1 anthraniloyl-IMP
-
 Bordetella pertussis
4.6.1.1 bis-acetamido-anthraniloyl-ITP
-
 Bordetella pertussis
4.6.1.1 methylanthraniloyl-ADP
-
 Bordetella pertussis
4.6.1.1 methylanthraniloyl-ATP
-
 Bordetella pertussis
4.6.1.1 methylanthraniloyl-CTP
-
 Bordetella pertussis
4.6.1.1 methylanthraniloyl-IDP
-
 Bordetella pertussis
4.6.1.1 methylanthraniloyl-IMP
-
 Bordetella pertussis
4.6.1.1 methylanthraniloyl-ITP
-
 Bordetella pertussis
4.6.1.1 additional information not inhibited by methylanthraniloyl-IMP and anthraniloyl-IMP Bordetella pertussis

Organism

EC Number Organism UniProt Comment Textmining
4.6.1.1 Bordetella pertussis
-
-
-

Substrates and Products (Substrate)

EC Number Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
4.6.1.1 ATP
-
 Bordetella pertussis 3',5'-cyclic-AMP + diphosphate
-
 ?

Synonyms

EC Number Synonyms Comment Organism
4.6.1.1 AC toxin
-
 Bordetella pertussis
4.6.1.1 adenylyl cyclase
-
 Bordetella pertussis
4.6.1.1 CyaA
-
 Bordetella pertussis

Cofactor

EC Number Cofactor Comment Organism Structure
4.6.1.1 Calmodulin
-
 Bordetella pertussis

Ki Value [mM]

EC Number Ki Value [mM] Ki Value maximum [mM] Inhibitor Comment Organism Structure
4.6.1.1 0.0000126
-
 2',3'-O-bis(5-bromoanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.000015
-
 2',3'-O-bis(5-chloroanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.000016
-
 2',3'-O-bis(5-chloroanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00002
-
 2',3'-O-bis(5-bromoanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.000091
-
 2',3'-O-bis(5-bromoanthraniloyl)-ADP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00028
-
 2',3'-O-bis(5-acetamidoanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00033
-
 3'-O-(5-bromoanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00035
-
 3'-O-(5-chloroanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00036
-
 2',3'-O-bis(5-methylanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0006
-
 methylanthraniloyl-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0007
-
 3'-O-(5-chloroanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0007
-
 2',3'-O-bis(5-propylanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00071
-
 3'-O-(5-acetamidoanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00082
-
 3'-O-(5-propylanthraniloyl)-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.00092
-
 3'-O-(5-bromoanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0011
-
 methylanthraniloyl-CTP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0021
-
 2',3'-O-bis(5-propylanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0025
-
 2',3'-O-bis(5-methylanthraniloyl)-CTP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.003
-
 2',3'-O-bis(5-methylanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0038
-
 3'-O-(5-propylanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0043
-
 methylanthraniloyl-ATP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0048
-
 3'-O-(5-acetamidoanthraniloyl)-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0065
-
 2',3'-O-bis(5-methylanthraniloyl)-ADP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0066
-
 2',3'-O-bis(5-methylanthraniloyl)-IDP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0075
-
 bis-acetamido-anthraniloyl-ITP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.0087
-
 3'-O-(5-bromoanthraniloyl)-ADP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.011
-
 methylanthraniloyl-IDP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.012
-
 methylanthraniloyl-ADP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.012
-
 2',3'-O-bis-anthraniloyl-IMP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis
4.6.1.1 0.02
-
 2',3'-O-bis(5-methylanthraniloyl)-IMP in 75 mM HEPES/NaOH, pH 7.4, at 25°C Bordetella pertussis