3IBI

The crystal structure of the human carbonic anhydrase II in complex with an aliphatic sulfamate inhibitor

Summary for 3IBI

Entry DOI	10.2210/pdb3ibi/pdb
Related	1CA2 3IBL 3IBN 3IBU
Descriptor	Carbonic anhydrase 2, ZINC ION, octyl sulfamate, ... (6 entities in total)
Functional Keywords	carbonic anhydrase ii, protein-inhibitor complex, aliphatic sulfamate inhibitor, disease mutation, metal-binding, lyase-lyase inhibitor complex, lyase/lyase inhibitor
Biological source	Homo sapiens (human)
Cellular location	Cytoplasm: P00918
Total number of polymer chains	1
Total formula weight	29806.74
Authors	Alterio, V.,De Simone, G. (deposition date: 2009-07-16, release date: 2009-09-22, Last modification date: 2023-11-01)
Primary citation	Vitale, R.M.,Alterio, V.,Innocenti, A.,Winum, J.-Y.,Monti, S.M.,De Simone, G.,Supuran, C.T. Carbonic anhydrase inhibitors. Comparison of aliphatic sulfamate/bis-sulfamate adducts with isozymes II and IX as a platform for designing tight-binding, more isoform-selective inhibitors J.Med.Chem., 52:5990-5998, 2009 Cited by PubMed: 19731956 DOI: 10.1021/jm900641r PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.93 Å)

Structure validation