3KXO: An orally active inhibitor bound at the active site of HPGDS

PDB ID: 3KXODownload
MMDB ID: 84549
PDB Deposition Date: 2009/12/3
Updated in MMDB: 2017/11
Experimental Method:
x-ray diffraction
Resolution: 2.1  Å
Source Organism:
Similar Structures:
Biological Unit for 3KXO: dimeric; determined by author and by software (PISA)
Molecular Components in 3KXO
Label Count Molecule
Proteins (2 molecules)
2
Glutathione-requiring Prostaglandin D Synthase
(Gene symbol: HPGDS)
Molecule annotation
Chemicals and Non-standard biopolymers (5 molecules)
1
2
GLUTATHIONEGLUTATHIONE
2
2
6-(3-fluorophenyl)-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyridine-3-carboxamide6-(3-fluorophenyl)-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyridine-3-carboxamide
3
1
MAGNESIUM IONMAGNESIUM 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