ISDA: 29SX

Deposition Date 2026-04-07

Release Date 2026-10-21

Last Version Date 2026-10-21

Entry Detail

PDB ID:

29SX

Keywords:

LYASE

Title:

Crystal structure of carbonic anhydrase XII with 2-(benzylthio)phenyl sulfamate

Biological Source:

Source Organism(s):

Homo sapiens (Taxon ID: 9606)

Expression System(s):

Escherichia coli bl21(de3)

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

1.85 Å

R-Value Free:

0.26

R-Value Work:

0.21

R-Value Observed:

0.21

Space Group:

P 1 21 1

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Macromolecular Entities

Structures with similar UniProt ID

Structural Superimposition Protein Blast

Polymer Type:polypeptide(L)
Molecule:Carbonic anhydrase 12
Gene (Uniprot):CA12
Chain IDs:A, B, C, D
Chain Length:263
Number of Molecules:4
Biological Source:Homo sapiens

UniProt ID:O43570 EC:4.2.1.1

Ligand Molecules

A1J4J

EDO

Primary Citation

Structure-Affinity and Selectivity of Aryl-Sulfamates as Inhibitors of Carbonic Anhydrase IX

Stancaitis, L, Liberis, M, Baranauskiene, L, Paketuryte-Latve, V, Kvietkauskaite, A, Petrauskas, V, Manakova, E, Smirnov, A, Mickeviciute, A, Juozapaitiene, V, Gedgaudas, M, Kojis, T, Matuliene, J, Grazulis, S, Capkauskaite, E, Matulis, D.Show

J.Med.Chem. 69 22993 23008 (2026)

DOI: 10.1021/acs.jmedchem.6c02393

Primary Citation of related structures

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