Literature summary for 2.3.3.9 extracted from

Costa, F.G.; Neto, B.R.; Goncalves, R.L.; da Silva, R.A.; de Oliveira, C.M.; Kato, L.; Freitas, C.d.S.; Giannini, M.J.; da Silva, J.d.F.; Soares, C.M.; Pereira, M.
Alkaloids as inhibitors of malate synthase from Paracoccidioides spp.: receptor-ligand interaction-based virtual screening and molecular docking studies, antifungal activity, and the adhesion process (2015), Antimicrob. Agents Chemother., 59, 5581-5594.

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Cloned(Commentary)

Cloned (Comment)	Organism
expressed in Escherichia coli BL21 C41(DE3) cells	Paracoccidioides sp.

Inhibitors

Inhibitors	Comment	Organism	Structure
16-ethenyl-21-oxo-19,20-didehydro-18-oxayohimban-17-yl hexopyranoside	-	Paracoccidioides sp.
3-ethenyl-2-(5-methoxy-9H-b-carbolin-1-yl)-1-methylcyclopentanol	-	Paracoccidioides sp.
9-(hydroxymethyl)-8-methyl-8,9,10,11,11a,12-hexahydro-6H-6,10:11,12a-dimethanoindolo[3,2-b]quinolizin-13-yl acetate	-	Paracoccidioides sp.
methyl 13-amino-2,11-dimethoxy-3-[(3,4,5-trimethoxybenzoyl)oxy]-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydroindeno[2',1':3,4]pyrido[1,2-b]isoquinoline-1-carboxylate	-	Paracoccidioides sp.
pyruvate	-	Paracoccidioides sp.

Natural Substrates/ Products (Substrates)

Natural Substrates	Organism	Comment (Nat. Sub.)	Natural Products	Comment (Nat. Pro.)	Rev.	Reac.
acetyl-CoA + H2O + glyoxylate	Paracoccidioides sp.	-	(S)-malate + CoA	-	?

Organism

Organism	UniProt	Comment	Textmining
Paracoccidioides sp.	-	-	-

Purification (Commentary)

Purification (Comment)	Organism
Ni-NTA column chromatography, and gel filtration	Paracoccidioides sp.

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
acetyl-CoA + H2O + glyoxylate	-	Paracoccidioides sp.	(S)-malate + CoA	-	?

Synonyms

Synonyms	Comment	Organism
MLS	-	Paracoccidioides sp.

IC50 Value

IC50 Value	IC50 Value Maximum	Comment	Organism	Inhibitor	Structure
additional information	-	IC50 of 0.0048 mg/ml	Paracoccidioides sp.	pyruvate
additional information	-	IC50 of 0.017 mg/ml	Paracoccidioides sp.	methyl 13-amino-2,11-dimethoxy-3-[(3,4,5-trimethoxybenzoyl)oxy]-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydroindeno[2',1':3,4]pyrido[1,2-b]isoquinoline-1-carboxylate
additional information	-	IC50 of 0.017 mg/ml	Paracoccidioides sp.	3-ethenyl-2-(5-methoxy-9H-b-carbolin-1-yl)-1-methylcyclopentanol
additional information	-	IC50 of 0.021 mg/ml	Paracoccidioides sp.	9-(hydroxymethyl)-8-methyl-8,9,10,11,11a,12-hexahydro-6H-6,10:11,12a-dimethanoindolo[3,2-b]quinolizin-13-yl acetate
additional information	-	IC50 of 0.029 mg/ml	Paracoccidioides sp.	16-ethenyl-21-oxo-19,20-didehydro-18-oxayohimban-17-yl hexopyranoside

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Release 2023.1 (January 2023)