2rbe

From Proteopedia

(Difference between revisions)
Jump to: navigation, search
Line 1: Line 1:
[[Image:2rbe.jpg|left|200px]]
[[Image:2rbe.jpg|left|200px]]
-
{{Structure
+
<!--
-
|PDB= 2rbe |SIZE=350|CAPTION= <scene name='initialview01'>2rbe</scene>, resolution 1.900&Aring;
+
The line below this paragraph, containing "STRUCTURE_2rbe", creates the "Structure Box" on the page.
-
|SITE=
+
You may change the PDB parameter (which sets the PDB file loaded into the applet)
-
|LIGAND= <scene name='pdbligand=NDP:NADPH+DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NDP</scene>, <scene name='pdbligand=ZMG:(5R)-2-[(2-FLUOROPHENYL)AMINO]-5-(1-METHYLETHYL)-1,3-THIAZOL-4(5H)-ONE'>ZMG</scene>
+
or the SCENE parameter (which sets the initial scene displayed when the page is loaded),
-
|ACTIVITY= <span class='plainlinks'>[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] </span>
+
or leave the SCENE parameter empty for the default display.
-
|GENE= HSD11B1, HSD11, HSD11L ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 Homo sapiens])
+
-->
-
|DOMAIN=
+
{{STRUCTURE_2rbe| PDB=2rbe | SCENE= }}
-
|RELATEDENTRY=
+
-
|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2rbe FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2rbe OCA], [http://www.ebi.ac.uk/pdbsum/2rbe PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=2rbe RCSB]</span>
+
-
}}
+
'''The discovery of 2-anilinothiazolones as 11beta-HSD1 inhibitors'''
'''The discovery of 2-anilinothiazolones as 11beta-HSD1 inhibitors'''
Line 29: Line 26:
[[Category: Li, V.]]
[[Category: Li, V.]]
[[Category: Zhang, J.]]
[[Category: Zhang, J.]]
-
[[Category: 3-layer(aba) sandwich]]
+
[[Category: Alpha beta]]
-
[[Category: alpha beta]]
+
[[Category: Endoplasmic reticulum]]
-
[[Category: endoplasmic reticulum]]
+
[[Category: Glycoprotein]]
-
[[Category: glycoprotein]]
+
[[Category: Lipid metabolism]]
-
[[Category: lipid metabolism]]
+
[[Category: Membrane]]
-
[[Category: membrane]]
+
[[Category: Microsome]]
-
[[Category: microsome]]
+
[[Category: Nadp]]
-
[[Category: nad(p)-binding rossmann-like domain]]
+
[[Category: Oxidoreductase]]
-
[[Category: nadp]]
+
[[Category: Polymorphism]]
-
[[Category: oxidoreductase]]
+
[[Category: Rossmann fold]]
-
[[Category: polymorphism]]
+
[[Category: Signal-anchor]]
-
[[Category: rossmann fold]]
+
[[Category: Steroid metabolism]]
-
[[Category: signal-anchor]]
+
[[Category: Transmembrane]]
-
[[Category: steroid metabolism]]
+
''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun May 4 16:36:14 2008''
-
[[Category: transmembrane]]
+
-
 
+
-
''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 04:58:34 2008''
+

Revision as of 13:36, 4 May 2008

Image:2rbe.jpg

Template:STRUCTURE 2rbe

The discovery of 2-anilinothiazolones as 11beta-HSD1 inhibitors


Overview

A series of 2-anilinothiazolones were prepared as inhibitors of 11beta-hydroxysteroid dehydrogenase type 1 (11beta-HSD1). The most potent compounds contained a 2-chloro or 2-fluoro group on the aniline ring with an isopropyl substituent on the 5-position of the thiazolone ring (compounds 2 and 3, respectively). The binding mode was determined through the X-ray co-crystal structure of the enzyme with compound 3. This compound was also approximately 70-fold selective over 11beta-HSD2 and was orally bioavailable in rat pharmacokinetic studies. However, compound 3 was >580-fold less active in the 11beta-HSD1 cell assay when tested in the presence of 3% human serum albumin.

About this Structure

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

Reference

The discovery of 2-anilinothiazolones as 11beta-HSD1 inhibitors., Yuan C, St Jean DJ Jr, Liu Q, Cai L, Li A, Han N, Moniz G, Askew B, Hungate RW, Johansson L, Tedenborg L, Pyring D, Williams M, Hale C, Chen M, Cupples R, Zhang J, Jordan S, Bartberger MD, Sun Y, Emery M, Wang M, Fotsch C, Bioorg Med Chem Lett. 2007 Nov 15;17(22):6056-61. Epub 2007 Sep 25. PMID:17919905 Page seeded by OCA on Sun May 4 16:36:14 2008

Proteopedia Page Contributors and Editors (what is this?)

OCA

Retrieved from "http://52.214.119.220/wiki/index.php/2rbe"
Personal tools