2oi0
From Proteopedia
(New page: 200px<br /><applet load="2oi0" size="350" color="white" frame="true" align="right" spinBox="true" caption="2oi0, resolution 2.000Å" /> '''Crystal structure a...) |
|||
| Line 4: | Line 4: | ||
==Overview== | ==Overview== | ||
| - | A series of potent thiol-containing aryl sulfonamide TACE inhibitors was | + | A series of potent thiol-containing aryl sulfonamide TACE inhibitors was designed and synthesized. The SAR and MMP selectivity of the series were investigated. In particular, compound 4b has shown excellent in vitro potency against the isolated TACE enzyme and good selectivity over MMP-2, -7, -8, -9, and -13. The X-ray structure of 4b bound to TACE was obtained. |
==About this Structure== | ==About this Structure== | ||
| Line 14: | Line 14: | ||
[[Category: Homo sapiens]] | [[Category: Homo sapiens]] | ||
[[Category: Single protein]] | [[Category: Single protein]] | ||
| - | [[Category: Bandarage, U | + | [[Category: Bandarage, U K.]] |
| - | [[Category: Rao, G | + | [[Category: Rao, G B.]] |
[[Category: Wei, Y.]] | [[Category: Wei, Y.]] | ||
[[Category: 283]] | [[Category: 283]] | ||
| Line 24: | Line 24: | ||
[[Category: tnf-a coverting enzyme]] | [[Category: tnf-a coverting enzyme]] | ||
| - | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on | + | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 18:18:46 2008'' |
Revision as of 16:18, 21 February 2008
|
Crystal structure analysis 0f the TNF-a Coverting Enzyme (TACE) in complexed with Aryl-sulfonamide
Overview
A series of potent thiol-containing aryl sulfonamide TACE inhibitors was designed and synthesized. The SAR and MMP selectivity of the series were investigated. In particular, compound 4b has shown excellent in vitro potency against the isolated TACE enzyme and good selectivity over MMP-2, -7, -8, -9, and -13. The X-ray structure of 4b bound to TACE was obtained.
About this Structure
2OI0 is a Single protein structure of sequence from Homo sapiens with and as ligands. Active as ADAM 17 endopeptidase, with EC number 3.4.24.86 Full crystallographic information is available from OCA.
Reference
Novel thiol-based TACE inhibitors: rational design, synthesis, and SAR of thiol-containing aryl sulfonamides., Govinda Rao B, Bandarage UK, Wang T, Come JH, Perola E, Wei Y, Tian SK, Saunders JO, Bioorg Med Chem Lett. 2007 Apr 15;17(8):2250-3. Epub 2007 Jan 26. PMID:17289381
Page seeded by OCA on Thu Feb 21 18:18:46 2008
