3QMO: X-ray crystal structure of NS-398 bound to the cyclooxygenase channel of cyclooxygenase-2

PDB ID: 3QMODownload
MMDB ID: 92350
PDB Deposition Date: 2011/2/4
Updated in MMDB: 2017/11
Experimental Method:
x-ray diffraction
Resolution: 3  Å
Source Organism:
Similar Structures:
Biological Unit for 3QMO: dimeric; determined by author and by software (PISA)
Molecular Components in 3QMO
Label Count Molecule
Proteins (2 molecules)
2
Prostaglandin G/H Synthase 2
(Gene symbol: Ptgs2)
Molecule annotation
Chemicals and Non-standard biopolymers (23 molecules)
1
8
2-acetamido-2-deoxy-beta-D-glucopyranose2-acetamido-2-deoxy-beta-D-glucopyranose
2
2
2-acetamido-2-deoxy-alpha-D-glucopyranose2-acetamido-2-deoxy-alpha-D-glucopyranose
3
1
beta-D-mannopyranosebeta-D-mannopyranose
4
6
GLYCEROLGLYCEROL
5
2
N-[2-(cyclohexyloxy)-4-nitrophenyl]methanesulfonamideN-[2-(cyclohexyloxy)-4-nitrophenyl]methanesulfonamide
6
2
PROTOPORPHYRIN IX CONTAINING FEPROTOPORPHYRIN IX CONTAINING FE
7
1
octyl beta-D-glucopyranosideoctyl beta-D-glucopyranoside
8
1
alpha-D-mannopyranosealpha-D-mannopyranose
* 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