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4XUI:
Crystal structure analysis of cruzain bound to the no-covalent analog of WRR-483 (WRR-669)
PDB ID:
4XUI
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MMDB ID:
127764
PDB Deposition Date:
2015/1/26
Updated in MMDB:
2023/10
Experimental Method:
x-ray diffraction
Resolution:
2.508 Å
Source Organism:
Trypanosoma cruzi
Similar Structures:
VAST+
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Biological Unit for 4XUI: monomeric; determined by author and by software (PISA)
Molecular Components in 4XUI
Label
Count
Molecule
Protein (1 molecule)
A
1
Cruzipain
Chemical and Non-standard biopolymers (1 molecule)
1
1
N-[(2S)-5-(carbamimidamidooxy)-1-oxo-1-{[(1E,3S)-5-phenyl-1-(pyrimidin-2-ylsulfonyl)pent-1-en-3-yl]amino}pentan-2-yl]-4-methylpiperazine-1-carboxamide
* 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