2irw
From Proteopedia
(New page: 200px<br /> <applet load="2irw" size="450" color="white" frame="true" align="right" spinBox="true" caption="2irw, resolution 3.100Å" /> '''Human 11-beta-Hydr...) |
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| - | [[Image:2irw.gif|left|200px]]<br /> | + | [[Image:2irw.gif|left|200px]]<br /><applet load="2irw" size="350" color="white" frame="true" align="right" spinBox="true" |
| - | <applet load="2irw" size=" | + | |
caption="2irw, resolution 3.100Å" /> | caption="2irw, resolution 3.100Å" /> | ||
'''Human 11-beta-Hydroxysteroid Dehydrogenase (HSD1) with NADP and Adamantane Ether Inhibitor'''<br /> | '''Human 11-beta-Hydroxysteroid Dehydrogenase (HSD1) with NADP and Adamantane Ether Inhibitor'''<br /> | ||
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==Overview== | ==Overview== | ||
A novel class of adamantane ethers 11beta-hydroxysteroid hydrogenase type, I inhibitors has been discovered. These compounds have excellent HSD-1, potency and selectivity against HSD-2. The structure-activity, relationships, selectivity, metabolism, PK, ex vivo pharmacodynamic data, and an X-ray crystal structure of one of these inhibitors bound to h-HSD-1, are discussed. | A novel class of adamantane ethers 11beta-hydroxysteroid hydrogenase type, I inhibitors has been discovered. These compounds have excellent HSD-1, potency and selectivity against HSD-2. The structure-activity, relationships, selectivity, metabolism, PK, ex vivo pharmacodynamic data, and an X-ray crystal structure of one of these inhibitors bound to h-HSD-1, are discussed. | ||
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| - | ==Disease== | ||
| - | Known diseases associated with this structure: Cortisone reductase deficiency OMIM:[[http://www.ncbi.nlm.nih.gov/entrez/dispomim.cgi?id=600713 600713]] | ||
==About this Structure== | ==About this Structure== | ||
| - | 2IRW 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 NAP and NN4 as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/11-beta-hydroxysteroid_dehydrogenase 11-beta-hydroxysteroid dehydrogenase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.1.1.146 1.1.1.146] Full crystallographic information is available from [http:// | + | 2IRW 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=NAP:'>NAP</scene> and <scene name='pdbligand=NN4:'>NN4</scene> as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/11-beta-hydroxysteroid_dehydrogenase 11-beta-hydroxysteroid dehydrogenase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.1.1.146 1.1.1.146] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2IRW OCA]. |
==Reference== | ==Reference== | ||
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[[Category: oxidoreductase]] | [[Category: oxidoreductase]] | ||
| - | ''Page seeded by [http:// | + | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Wed Jan 23 12:32:00 2008'' |
Revision as of 10:32, 23 January 2008
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Human 11-beta-Hydroxysteroid Dehydrogenase (HSD1) with NADP and Adamantane Ether Inhibitor
Overview
A novel class of adamantane ethers 11beta-hydroxysteroid hydrogenase type, I inhibitors has been discovered. These compounds have excellent HSD-1, potency and selectivity against HSD-2. The structure-activity, relationships, selectivity, metabolism, PK, ex vivo pharmacodynamic data, and an X-ray crystal structure of one of these inhibitors bound to h-HSD-1, are discussed.
About this Structure
2IRW is a Single protein structure of sequence from Homo sapiens with and as ligands. Active as 11-beta-hydroxysteroid dehydrogenase, with EC number 1.1.1.146 Full crystallographic information is available from OCA.
Reference
Discovery of adamantane ethers as inhibitors of 11beta-HSD-1: Synthesis and biological evaluation., Patel JR, Shuai Q, Dinges J, Winn M, Pliushchev M, Fung S, Monzon K, Chiou W, Wang J, Pan L, Wagaw S, Engstrom K, Kerdesky FA, Longenecker K, Judge R, Qin W, Imade HM, Stolarik D, Beno DW, Brune M, Chovan LE, Sham HL, Jacobson P, Link JT, Bioorg Med Chem Lett. 2007 Feb 1;17(3):750-5. Epub 2006 Oct 28. PMID:17110106
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