2q2z

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spinqualitylabelsall models 2q2z, resolution 3.00Å Show:Asymmetric Unit Biological Assembly Drag the structure with the mouse to rotate   Export Animated Image

Crystal Structure of KSP in Complex with Inhibitor 22

Overview

Inspired by previous efforts in the pyrazolobenzoxazine class of KSP, inhibitors, the design and synthesis of 1,4-diaryl-4,5-dihydropyrazole, inhibitors of KSP are described. Crystallographic evidence of binding mode, and in vivo potency data is also highlighted.

About this Structure

2Q2Z is a Single protein structure of sequence from Homo sapiens with , and as ligands. Full crystallographic information is available from OCA.

Reference

Kinesin spindle protein (KSP) inhibitors. Part 8: Design and synthesis of 1,4-diaryl-4,5-dihydropyrazoles as potent inhibitors of the mitotic kinesin KSP., Roecker AJ, Coleman PJ, Mercer SP, Schreier JD, Buser CA, Walsh ES, Hamilton K, Lobell RB, Tao W, Diehl RE, South VJ, Davide JP, Kohl NE, Yan Y, Kuo LC, Li C, Fernandez-Metzler C, Mahan EA, Prueksaritanont T, Hartman GD, Bioorg Med Chem Lett. 2007 Oct 15;17(20):5677-82. Epub 2007 Aug 21. PMID:17766111

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