Literature summary for 4.2.1.1 extracted from

Schlicker, C.; Hall, R.A.; Vullo, D.; Middelhaufe, S.; Gertz, M.; Supuran, C.T.; Muehlschlegel, F.A.; Steegborn, C.
Structure and inhibition of the CO2-sensing carbonic anhydrase Can2 from the pathogenic fungus Cryptococcus neoformans (2009), J. Mol. Biol., 385, 1207-1220.

Crystallization (Commentary)

Crystallization (Comment)	Organism
Can2 in complex with acetate, hanging drop vapour diffusion method	Cryptococcus neoformans

Inhibitors

Inhibitors	Comment	Organism
3-bromo-4-amino-benzenesulfonamide	-	Cryptococcus neoformans
3-chloro-4-amino-benzenesulfonamide	-	Cryptococcus neoformans
3-fluoro-4-amino-benzenesulfonamide	-	Cryptococcus neoformans
3-iodo-4-amino-benzenesulfonamide	-	Cryptococcus neoformans
4-(2-amino-pyrimidin-4-yl)-benzenesulfonamide	-	Cryptococcus neoformans
4-(4-sulfanilyl-aminoethyl)-benzenesulfonamide	-	Cryptococcus neoformans
4-(4-sulfanilyl-aminomethyl)-benzenesulfonamide	-	Cryptococcus neoformans
4-(carboxyethyl)-benzenesulfonamide	-	Cryptococcus neoformans
4-amino-6-chloro-benzene-1,3-disulfonamide	-	Cryptococcus neoformans
4-amino-6-trifluoromethyl-benzene-1,3-disulfonamide	-	Cryptococcus neoformans
4-amino-benzenesulfonamide	-	Cryptococcus neoformans
4-aminoethyl-benzenesulfonamide	-	Cryptococcus neoformans
4-aminomethyl-benzenesulfonamide	-	Cryptococcus neoformans
4-carboxy-benzenesulfonamide	-	Cryptococcus neoformans
4-hydroxyethyl-benzenesulfonamide	-	Cryptococcus neoformans
4-hydroxymethyl-benzenesulfonamide	-	Cryptococcus neoformans
4-methyl-5-imino-1,3,4-thiadiazoline-2-sulfonamide	-	Cryptococcus neoformans
4-methyl-benzenesulfonamide	-	Cryptococcus neoformans
5-amino-1,3,4-thiadiazole-2-sulfonamide	-	Cryptococcus neoformans
acetate	-	Cryptococcus neoformans
aminobenzolamide	-	Cryptococcus neoformans
benzolamide	-	Cryptococcus neoformans
brinzolamide	-	Cryptococcus neoformans
celecoxib	-	Cryptococcus neoformans
chlorazolamide	-	Cryptococcus neoformans
dichlorophenamide	-	Cryptococcus neoformans
dorzolamide	-	Cryptococcus neoformans
ethoxzolamide	-	Cryptococcus neoformans
indisulam	-	Cryptococcus neoformans
methazolamide	-	Cryptococcus neoformans
N-(5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl)acetamide	-	Cryptococcus neoformans
saccharin	-	Cryptococcus neoformans
sulpiride	-	Cryptococcus neoformans
sulthiame	-	Cryptococcus neoformans
topiramate	-	Cryptococcus neoformans
valdecoxib	-	Cryptococcus neoformans
zonisamide	-	Cryptococcus neoformans

Metals/Ions

Metals/Ions	Comment	Organism	Structure
Zn2+	contains one Zn2+ per monomer	Cryptococcus neoformans

Organism

Organism	UniProt	Comment	Textmining
Cryptococcus neoformans	-	-	-

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
CO2 + H2O	-	Cryptococcus neoformans	H2CO3	-	r

Subunits

Subunits	Comment	Organism
dimer	x-ray crystallography	Cryptococcus neoformans

Synonyms

Synonyms	Comment	Organism
Can2	-	Cryptococcus neoformans
carbonic anhydrase	-	Cryptococcus neoformans

Ki Value [mM]

Ki Value [mM]	Ki Value maximum [mM]	Inhibitor	Comment	Organism
0.0000105	-	N-(5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl)acetamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000023	-	benzolamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000042	-	aminobenzolamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000063	-	methazolamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000087	-	ethoxzolamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000087	-	brinzolamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.0003	-	4-amino-6-chloro-benzene-1,3-disulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000367	-	topiramate	at 20°C, pH 8.3	Cryptococcus neoformans
0.000379	-	chlorazolamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.00044	-	4-(carboxyethyl)-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000484	-	4-carboxy-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000605	-	3-chloro-4-amino-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000623	-	4-hydroxymethyl-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000624	-	4-(4-sulfanilyl-aminoethyl)-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000704	-	valdecoxib	at 20°C, pH 8.3	Cryptococcus neoformans
0.000711	-	3-iodo-4-amino-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000765	-	4-amino-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000791	-	5-amino-1,3,4-thiadiazole-2-sulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000809	-	3-fluoro-4-amino-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000812	-	sulpiride	at 20°C, pH 8.3	Cryptococcus neoformans
0.000815	-	4-methyl-5-imino-1,3,4-thiadiazoline-2-sulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000878	-	4-hydroxyethyl-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.00089	-	sulthiame	at 20°C, pH 8.3	Cryptococcus neoformans
0.000963	-	indisulam	at 20°C, pH 8.3	Cryptococcus neoformans
0.000968	-	4-amino-6-trifluoromethyl-benzene-1,3-disulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000971	-	zonisamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000971	-	4-(4-sulfanilyl-aminomethyl)-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.000977	-	3-bromo-4-amino-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.00115	-	4-methyl-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.001203	-	dichlorophenamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.001394	-	4-aminoethyl-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.003056	-	celecoxib	at 20°C, pH 8.3	Cryptococcus neoformans
0.003887	-	4-(2-amino-pyrimidin-4-yl)-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.008347	-	dorzolamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.01849	-	4-aminomethyl-benzenesulfonamide	at 20°C, pH 8.3	Cryptococcus neoformans
0.032	-	saccharin	at 20°C, pH 8.3	Cryptococcus neoformans