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Literature summary extracted from

  • Hossain, M.M.; Roy, P.K.; Mosnaz, A.T.; Shakil, S.K.; Hasan, M.M.; Prodhan, S.H.
    Structural analysis and molecular docking of potential ligands with chorismate synthase of Listeria monocytogenes a novel antibacterial drug target (2015), Indian J. Biochem. Biophys., 52, 45-59 .
    View publication on PubMed

Inhibitors

EC Number Inhibitors Comment Organism Structure
4.2.3.5 (17beta)-17-(4-hydroxybenzoyl)androsta-3,5-diene-3-carboxylic acid
-
 Listeria monocytogenes
4.2.3.5 (2E)-5,7-dihydroxy-2-[[4-(pyrrolidin-1-yl)phenyl]methylidene]-1-benzofuran-3(2H)-one
-
 Listeria monocytogenes
4.2.3.5 (2E)-5,7-dihydroxy-2-[[4-(trifluoromethyl)phenyl]methylidene]-1-benzofuran-3(2H)-one
-
 Listeria monocytogenes
4.2.3.5 (2E)-6,7-dihydroxy-2-([2-hydroxy-4-[(6-hydroxyhexyl)oxy]phenyl]methylidene)-1-benzofuran-3(2H)-one
-
 Listeria monocytogenes
4.2.3.5 ([1,1'-biphenyl]-4-yl)(4-nitrophenyl)methanone
-
 Listeria monocytogenes
4.2.3.5 1-(naphthalen-2-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
-
 Listeria monocytogenes
4.2.3.5 3,4-di(1H-indol-3-yl)-1H-pyrrole-2,5-dicarboxylic acid
-
 Listeria monocytogenes
4.2.3.5 4-[(E)-(5,7-dihydroxy-3-oxo-1-benzofuran-2(3H)-ylidene)methyl]benzoic acid
-
 Listeria monocytogenes
4.2.3.5 4-[7-(hydroxymethyl)-1-benzofuran-2-yl]-7-methyl-2-oxo-2H-1-benzopyran-6-yl furan-2-carboxylate
-
 Listeria monocytogenes
4.2.3.5 4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid
-
 Listeria monocytogenes
4.2.3.5 6-fluoro-2-(2'-fluoro[1,1'-biphenyl]-4-yl)-3-methylquinoline-4-carboxylic acid
-
 Listeria monocytogenes
4.2.3.5 CHEMBL135212
-
 Listeria monocytogenes
4.2.3.5 CHEMBL335859
-
 Listeria monocytogenes
4.2.3.5 CHEMBL336282
-
 Listeria monocytogenes
4.2.3.5 CHEMBL338732
-
 Listeria monocytogenes
4.2.3.5 N-(2-benzoyl-3-methyl-1-benzofuran-6-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
-
 Listeria monocytogenes
4.2.3.5 N-(3-chlorophenyl)-N-methyl-2-oxo-3-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methyl]-2H-indole-5-sulfonamide
-
 Listeria monocytogenes
4.2.3.5 N-[2-(4-methoxybenzoyl)-3-methyl-1-benzofuran-5-yl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide
-
 Listeria monocytogenes
4.2.3.5 N-[5-(1,1-dioxo-1lambda6,2-thiazolidin-2-yl)-1H-indazol-3-yl]-2-[4-(piperidin-1-yl)phenyl]acetamide
-
 Listeria monocytogenes
4.2.3.5 ZINC00602427
-
 Listeria monocytogenes
4.2.3.5 ZINC01163259
-
 Listeria monocytogenes
4.2.3.5 ZINC01587011
-
 Listeria monocytogenes
4.2.3.5 ZINC03803450
-
 Listeria monocytogenes
4.2.3.5 ZINC09708077
-
 Listeria monocytogenes
4.2.3.5 ZINC13387711
-
 Listeria monocytogenes
4.2.3.5 ZINC13681793
-
 Listeria monocytogenes
4.2.3.5 ZINC13682976
-
 Listeria monocytogenes
4.2.3.5 ZINC16052528
-
 Listeria monocytogenes
4.2.3.5 ZINC20149031
-
 Listeria monocytogenes

Natural Substrates/ Products (Substrates)

EC Number Natural Substrates Organism Comment (Nat. Sub.) Natural Products Comment (Nat. Pro.) Rev. Reac.
4.2.3.5 5-O-(1-carboxyvinyl)-3-phosphoshikimate Listeria monocytogenes
-
 chorismate + phosphate
-
 ?
4.2.3.5 5-O-(1-carboxyvinyl)-3-phosphoshikimate Listeria monocytogenes F2365
-
 chorismate + phosphate
-
 ?

Organism

EC Number Organism UniProt Comment Textmining
4.2.3.5 Listeria monocytogenes Q71Y87
-
-
4.2.3.5 Listeria monocytogenes F2365 Q71Y87
-
-

Substrates and Products (Substrate)

EC Number Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
4.2.3.5 5-O-(1-carboxyvinyl)-3-phosphoshikimate
-
 Listeria monocytogenes chorismate + phosphate
-
 ?
4.2.3.5 5-O-(1-carboxyvinyl)-3-phosphoshikimate
-
 Listeria monocytogenes F2365 chorismate + phosphate
-
 ?

Subunits

EC Number Subunits Comment Organism
4.2.3.5 ? x * 42188, calculated from amino acid sequence Listeria monocytogenes

Ki Value [mM]

EC Number Ki Value [mM] Ki Value maximum [mM] Inhibitor Comment Organism Structure
4.2.3.5 0.00000061461
-
 4-[(E)-(5,7-dihydroxy-3-oxo-1-benzofuran-2(3H)-ylidene)methyl]benzoic acid pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00000061461
-
 CHEMBL338732 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.0000021
-
 (17beta)-17-(4-hydroxybenzoyl)androsta-3,5-diene-3-carboxylic acid pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.0000021
-
 ZINC03803450 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00000832
-
 1-(naphthalen-2-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00000832
-
 ZINC01163259 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00001663
-
 N-[2-(4-methoxybenzoyl)-3-methyl-1-benzofuran-5-yl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00001663
-
 ZINC13682976 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00001691
-
 4-[8-(3-nitrophenyl)-1,7-naphthyridin-6-yl]benzoic acid pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00001691
-
 ZINC00602427 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00002031
-
 N-[5-(1,1-dioxo-1lambda6,2-thiazolidin-2-yl)-1H-indazol-3-yl]-2-[4-(piperidin-1-yl)phenyl]acetamide pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00002031
-
 ZINC20149031 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00002294
-
 3,4-di(1H-indol-3-yl)-1H-pyrrole-2,5-dicarboxylic acid pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00002294
-
 ZINC13387711 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00003099
-
 N-(2-benzoyl-3-methyl-1-benzofuran-6-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00003099
-
 ZINC13681793 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00003336
-
 4-[7-(hydroxymethyl)-1-benzofuran-2-yl]-7-methyl-2-oxo-2H-1-benzopyran-6-yl furan-2-carboxylate pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00003336
-
 ZINC09708077 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00003732
-
 ([1,1'-biphenyl]-4-yl)(4-nitrophenyl)methanone pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00003809
-
 6-fluoro-2-(2'-fluoro[1,1'-biphenyl]-4-yl)-3-methylquinoline-4-carboxylic acid pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00003809
-
 ZINC01587011 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00149
-
 CHEMBL335859 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.00149
-
 (2E)-5,7-dihydroxy-2-[[4-(pyrrolidin-1-yl)phenyl]methylidene]-1-benzofuran-3(2H)-one pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.01207
-
 CHEMBL336282 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.01207
-
 (2E)-6,7-dihydroxy-2-([2-hydroxy-4-[(6-hydroxyhexyl)oxy]phenyl]methylidene)-1-benzofuran-3(2H)-one pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.03584
-
 N-(3-chlorophenyl)-N-methyl-2-oxo-3-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methyl]-2H-indole-5-sulfonamide pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.03584
-
 ZINC16052528 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.03944
-
 CHEMBL135212 pH and temperature not specified in the publication Listeria monocytogenes
4.2.3.5 0.03944
-
 (2E)-5,7-dihydroxy-2-[[4-(trifluoromethyl)phenyl]methylidene]-1-benzofuran-3(2H)-one pH and temperature not specified in the publication Listeria monocytogenes

pI Value

EC Number Organism Comment pI Value Maximum pI Value
4.2.3.5 Listeria monocytogenes calculated from amino acid sequence
-
 6.6