1yk7
From Proteopedia
(New page: 200px<br /> <applet load="1yk7" size="450" color="white" frame="true" align="right" spinBox="true" caption="1yk7, resolution 2.5Å" /> '''Cathepsin K complexe...) |
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| - | [[Image:1yk7.gif|left|200px]]<br /> | + | [[Image:1yk7.gif|left|200px]]<br /><applet load="1yk7" size="350" color="white" frame="true" align="right" spinBox="true" |
| - | <applet load="1yk7" size=" | + | |
caption="1yk7, resolution 2.5Å" /> | caption="1yk7, resolution 2.5Å" /> | ||
'''Cathepsin K complexed with a cyanopyrrolidine inhibitor'''<br /> | '''Cathepsin K complexed with a cyanopyrrolidine inhibitor'''<br /> | ||
==Overview== | ==Overview== | ||
| - | Starting from a PDE IV inhibitor hit derived from high throughput | + | Starting from a PDE IV inhibitor hit derived from high throughput screening of the compound collection, a key pyrrolidine cyanamide pharmacophore was identified. Modifications of the pyrrolidine ring produced enhancements in cathepsin K inhibition. An X-ray co-crystal structure of a cyanamide with cathepsin K confirmed the mode of inhibition. |
==Disease== | ==Disease== | ||
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==About this Structure== | ==About this Structure== | ||
| - | 1YK7 is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens] with NBL as [http://en.wikipedia.org/wiki/ligand ligand]. Active as [http://en.wikipedia.org/wiki/Cathepsin_K Cathepsin K], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=3.4.22.38 3.4.22.38] Full crystallographic information is available from [http:// | + | 1YK7 is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens] with <scene name='pdbligand=NBL:'>NBL</scene> as [http://en.wikipedia.org/wiki/ligand ligand]. Active as [http://en.wikipedia.org/wiki/Cathepsin_K Cathepsin K], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=3.4.22.38 3.4.22.38] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1YK7 OCA]. |
==Reference== | ==Reference== | ||
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[[Category: Homo sapiens]] | [[Category: Homo sapiens]] | ||
[[Category: Single protein]] | [[Category: Single protein]] | ||
| - | [[Category: Barrett, D | + | [[Category: Barrett, D G.]] |
| - | [[Category: Deaton, D | + | [[Category: Deaton, D N.]] |
| - | [[Category: Hassell, A | + | [[Category: Hassell, A M.]] |
| - | [[Category: McFadyen, R | + | [[Category: McFadyen, R B.]] |
| - | [[Category: Miller, A | + | [[Category: Miller, A B.]] |
| - | [[Category: Miller, L | + | [[Category: Miller, L R.]] |
| - | [[Category: Shewchuk, L | + | [[Category: Shewchuk, L M.]] |
| - | [[Category: Tavares, F | + | [[Category: Tavares, F X.]] |
| - | [[Category: Willard, D | + | [[Category: Willard, D H.]] |
| - | [[Category: Wright, L | + | [[Category: Wright, L L.]] |
[[Category: NBL]] | [[Category: NBL]] | ||
[[Category: cathepsin]] | [[Category: cathepsin]] | ||
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[[Category: protease]] | [[Category: protease]] | ||
| - | ''Page seeded by [http:// | + | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 16:06:08 2008'' |
Revision as of 14:06, 21 February 2008
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Cathepsin K complexed with a cyanopyrrolidine inhibitor
Contents |
Overview
Starting from a PDE IV inhibitor hit derived from high throughput screening of the compound collection, a key pyrrolidine cyanamide pharmacophore was identified. Modifications of the pyrrolidine ring produced enhancements in cathepsin K inhibition. An X-ray co-crystal structure of a cyanamide with cathepsin K confirmed the mode of inhibition.
Disease
Known disease associated with this structure: Pycnodysostosis OMIM:[601105]
About this Structure
1YK7 is a Single protein structure of sequence from Homo sapiens with as ligand. Active as Cathepsin K, with EC number 3.4.22.38 Full crystallographic information is available from OCA.
Reference
Novel and potent cyclic cyanamide-based cathepsin K inhibitors., Deaton DN, Hassell AM, McFadyen RB, Miller AB, Miller LR, Shewchuk LM, Tavares FX, Willard DH Jr, Wright LL, Bioorg Med Chem Lett. 2005 Apr 1;15(7):1815-9. PMID:15780613
Page seeded by OCA on Thu Feb 21 16:06:08 2008
Categories: Cathepsin K | Homo sapiens | Single protein | Barrett, D G. | Deaton, D N. | Hassell, A M. | McFadyen, R B. | Miller, A B. | Miller, L R. | Shewchuk, L M. | Tavares, F X. | Willard, D H. | Wright, L L. | NBL | Cathepsin | Catk | Cysteine | Protease
