1wzy

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Crystal structure of human ERK2 complexed with a pyrazolopyridazine derivativeCrystal structure of human ERK2 complexed with a pyrazolopyridazine derivative

Structural highlights

1wzy is a 1 chain structure with sequence from Homo sapiens. Full crystallographic information is available from OCA. For a guided tour on the structure components use FirstGlance.
Ligands:
Activity:Non-specific serine/threonine protein kinase, with EC number 2.7.11.1
Resources:FirstGlance, OCA, RCSB, PDBsum

Evolutionary Conservation

Check, as determined by ConSurfDB. You may read the explanation of the method and the full data available from ConSurf.

Publication Abstract from PubMed

A series of pyrazolopyridazine compounds were briefly investigated as ERK2 inhibitors. The crystal structure of ERK2 complexed with an allyl derivative was determined. The compound induces structural change including movement of the glycine-rich loop and peptide flip between Met108-Glu109. As a result, the newly formed subsite can recognize small hydrophobic substituents but not hydrophilic ones.

Crystal structure of human ERK2 complexed with a pyrazolo[3,4-c]pyridazine derivative.,Kinoshita T, Warizaya M, Ohori M, Sato K, Neya M, Fujii T Bioorg Med Chem Lett. 2006 Jan 1;16(1):55-8. Epub 2005 Oct 18. PMID:16242327[1]

From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.

See Also

References

  1. Kinoshita T, Warizaya M, Ohori M, Sato K, Neya M, Fujii T. Crystal structure of human ERK2 complexed with a pyrazolo[3,4-c]pyridazine derivative. Bioorg Med Chem Lett. 2006 Jan 1;16(1):55-8. Epub 2005 Oct 18. PMID:16242327 doi:10.1016/j.bmcl.2005.09.055

1wzy, resolution 2.50Å

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