3NT1

High resolution structure of naproxen:COX-2 complex.

Summary for 3NT1

Related3PGH 1PXX 1CQE 3NTB
DescriptorProstaglandin-endoperoxide synthase 2, N-ACETYL-D-GLUCOSAMINE, B-OCTYLGLUCOSIDE, ... (7 entities in total)
Functional Keywordsprostaglandin h2 synthase, cyclooxygenase-2, naproxen, oxidoreductase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
Biological sourceMus musculus (mouse)
Total number of polymer chains2
Total molecular weight139368.96
Authors
Duggan, K.C.,Musee, J.,Walters, M.J.,Harp, J.M.,Kiefer, J.R.,Oates, J.A.,Marnett, L.J. (deposition date: 2010-07-02, release date: 2010-09-01, Last modification date: 2017-11-08)
Primary citation
Duggan, K.C.,Walters, M.J.,Musee, J.,Harp, J.M.,Kiefer, J.R.,Oates, J.A.,Marnett, L.J.
Molecular basis for cyclooxygenase inhibition by the non-steroidal anti-inflammatory drug naproxen.
J.Biol.Chem., 285:34950-34959, 2010
PubMed: 20810665 (PDB entries with the same primary citation)
DOI: 10.1074/jbc.M110.162982
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.73 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.200201.8%7.0%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 3nt1
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Molmil generated image of 3nt1
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Molmil generated image of 3nt1
rotated about y axis by 90°