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Structure paper

TitleFatty Acid Binding to the Allosteric Subunit of Cyclooxygenase-2 Relieves a Tonic Inhibition of the Catalytic Subunit.
Journal, issue, pagesJ. Biol. Chem., Vol. 291, Page 25641-25655, Year 2016
Publish dateMay 11, 2016 (structure data deposition date)
AuthorsDong, L. / Yuan, C. / Orlando, B.J. / Malkowski, M.G. / Smith, W.L.
External linksJ. Biol. Chem. / PubMed:27756840
MethodsX-ray diffraction
Resolution2.36 - 2.822 Å
Structure data

PDB-5jvy:
Crystal structure of S121P murine COX-2 mutant
Method: X-RAY DIFFRACTION / Resolution: 2.36 Å

PDB-5jvz:
Crystal structure of flurbiprofen bound to S121P murine COX-2 mutant
Method: X-RAY DIFFRACTION / Resolution: 2.62 Å

PDB-5jw1:
Crystal structure of Celecoxib bound to S121P murine COX-2 mutant
Method: X-RAY DIFFRACTION / Resolution: 2.822 Å

Chemicals

ChemComp-COH:
PROTOPORPHYRIN IX CONTAINING CO

ChemComp-BOG:
octyl beta-D-glucopyranoside / detergent*YM

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-AKR:
ACRYLIC ACID

ChemComp-HOH:
WATER

ChemComp-FLP:
FLURBIPROFEN / antiinflammatory*YM

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-CEL:
4-[5-(4-METHYLPHENYL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-1-YL]BENZENESULFONAMIDE / antiinflammatory, inhibitor*YM

Source
  • mus musculus (house mouse)
KeywordsOXIDOREDUCTASE / Cyclooxygenase / COX / NSAID / COX-2 / Flurbiprofen / FBP / celebrex / coxib / celecoxib

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