2pjt

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Revision as of 06:39, 24 April 2008

Image:2pjt.jpg

Template:STRUCTURE 2pjt

Crystal structure of the catalytic domain of MMP-13 complexed with WAY-344


Overview

A series of beta-sulfonyl hydroxamate TACE inhibitors, bearing a butynylamino or a butynyloxy P1' group, was designed and synthesized. Of the compounds investigated, 22 has excellent potency against isolated TACE enzyme, shows good selectivity over MMP-2 and MMP-13, and oral activity in an in vivo mouse model of TNF-alpha production.

About this Structure

2PJT is a Single protein structure of sequence from Homo sapiens. Full crystallographic information is available from OCA.

Reference

Structure-based design of TACE selective inhibitors: manipulations in the S1'-S3' pocket., Huang A, Joseph-McCarthy D, Lovering F, Sun L, Wang W, Xu W, Zhu Y, Cui J, Zhang Y, Levin JI, Bioorg Med Chem. 2007 Sep 15;15(18):6170-81. Epub 2007 Jun 20. PMID:17606376 Page seeded by OCA on Thu Apr 24 09:39:12 2008

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