5BRU: Catalytic Improvement of an Artificial Metalloenzyme by Computational Design

PDB ID: 5BRUDownload
MMDB ID: 130382
PDB Deposition Date: 2015/6/1
Updated in MMDB: 2026/08
Experimental Method:
x-ray diffraction
Resolution: 1.6  Å
Source Organism:
Similar Structures:
Biological Unit for 5BRU: monomeric; determined by author and by software (PISA)
Molecular Components in 5BRU
Label Count Molecule
Protein (1 molecule)
1
Carbonic Anhydrase 2
(Gene symbol: CA2)
Molecule annotation
Chemicals and Non-standard biopolymers (4 molecules)
1
1
ZINC IONZINC ION
2
1
[(benzenesulfonyl){[4-(4-sulfamoylphenyl)pyridin-2-yl-kappaN]methyl}azanido-kappaN]chlorido[(1,2,3,4,5-eta)-1,2,3,5-tetramethyl-4-propylcyclopentadienyl]iridium[(benzenesulfonyl){[4-(4-sulfamoylphenyl)pyridin-2-yl-kappaN]methyl}azanido-kappaN]chlorido[(1,2,3,4,5-eta)-1,2,3,5-tetramethyl-4-propylcyclopentadienyl]iridium
3
2
SULFATE IONSULFATE ION
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH. " MMDB and VAST+: tracking structural similarities between macromolecular complexes. Nucleic Acids Res. 2014 Jan; 42(Database issue):D297-303