3Q3Y: Complex structure of HEVB EV93 main protease 3C with Compound 1 (AG7404)

PDB ID: 3Q3YDownload
MMDB ID: 93453
PDB Deposition Date: 2010/12/22
Updated in MMDB: 2011/10
Experimental Method:
x-ray diffraction
Resolution: 1.32  Å
Source Organism:
Similar Structures:
Biological Unit for 3Q3Y: monomeric; determined by author
Molecular Components in 3Q3Y
Label Count Molecule
Protein (1 molecule)
1
Hevb Ev93 3C Protease
Molecule annotation
Chemicals and Non-standard biopolymers (9 molecules)
1
1
ethyl (4R)-4-({(2S)-2-[3-{[(5-methyl-1,2-oxazol-3-yl)carbonyl]amino}-2-oxopyridin-1(2H)-yl]pent-4-ynoyl}amino)-5-[(3S)-2-oxopyrrolidin-3-yl]pentanoateethyl (4R)-4-({(2S)-2-[3-{[(5-methyl-1,2-oxazol-3-yl)carbonyl]amino}-2-oxopyridin-1(2H)-yl]pent-4-ynoyl}amino)-5-[(3S)-2-oxopyrrolidin-3-yl]pentanoate
2
4
1,2-ETHANEDIOL1,2-ETHANEDIOL
3
2
HYDROGENPHOSPHATE IONHYDROGENPHOSPHATE ION
4
2
AMMONIUM IONAMMONIUM 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