Tne crystal structure of the human carbonic anhydrase II in complex with a fluorescent inhibitor

Structure

x-ray diffraction · 1 distinct chain · 14% helix, 30% strand (DSSP).

Ligands and binding sites

• HGB · 4-(hydroxymercury)benzoic acid · ligand · chains A
• FL1 · 5-{[({2-[4-(aminosulfonyl)phenyl]ethyl}amino)carbonothioyl]amino}-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid · ligand · chains A
• ZN · Zinc ion · metal · chains A
• GOL · Glycerol · additive · 2 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

Compared structures

• 2F14 · Tne Crystal Structure of the Human Carbonic Anhydrase II in Complex with a Fluorescent… · the same entry in another collection · chain A against A, TM-score 1.00
• P00918 · AlphaFold monomer V2.0 prediction for carbonic anhydrase 2 (P00918) · a predicted model of the same protein · chain A against A, TM-score 0.99

Analyse

• Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
• Every structure of UniProt P00918
• Elsewhere: RCSB PDB 2F14 · PDBe 2F14 · UniProt P00918