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[[Image:3byz.jpg|left|200px]]<br /><applet load="3byz" size="350" color="white" frame="true" align="right" spinBox="true"
caption="3byz, resolution 2.69&Aring;" />
'''2-Amino-1,3-thiazol-4(5H)-ones as Potent and Selective 11-Hydroxysteroid Dehydrogenase Type 1 Inhibitors'''<br />


==About this Structure==
==2-Amino-1,3-thiazol-4(5H)-ones as Potent and Selective 11-Hydroxysteroid Dehydrogenase Type 1 Inhibitors==
3BYZ 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=NDP:'>NDP</scene> and <scene name='pdbligand=H11:'>H11</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] Known structural/functional Sites: <scene name='pdbsite=AC1:Ndp+Binding+Site+For+Residue+A+501'>AC1</scene>, <scene name='pdbsite=AC2:Ndp+Binding+Site+For+Residue+B+502'>AC2</scene>, <scene name='pdbsite=AC3:Ndp+Binding+Site+For+Residue+C+503'>AC3</scene>, <scene name='pdbsite=AC4:Ndp+Binding+Site+For+Residue+D+504'>AC4</scene>, <scene name='pdbsite=AC5:H11+Binding+Site+For+Residue+A+601'>AC5</scene>, <scene name='pdbsite=AC6:H11+Binding+Site+For+Residue+B+602'>AC6</scene>, <scene name='pdbsite=AC7:H11+Binding+Site+For+Residue+D+603'>AC7</scene> and <scene name='pdbsite=AC8:H11+Binding+Site+For+Residue+C+604'>AC8</scene>. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3BYZ OCA].  
<StructureSection load='3byz' size='340' side='right'caption='[[3byz]], [[Resolution|resolution]] 2.69&Aring;' scene=''>
[[Category: 11-beta-hydroxysteroid dehydrogenase]]
== Structural highlights ==
<table><tr><td colspan='2'>[[3byz]] is a 4 chain structure with sequence from [https://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3BYZ OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3BYZ FirstGlance]. <br>
</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 2.69&#8491;</td></tr>
<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=H11:(5S)-2-(CYCLOOCTYLAMINO)-5-METHYL-5-PROPYL-1,3-THIAZOL-4(5H)-ONE'>H11</scene>, <scene name='pdbligand=NDP:NADPH+DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NDP</scene></td></tr>
<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=3byz FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3byz OCA], [https://pdbe.org/3byz PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3byz RCSB], [https://www.ebi.ac.uk/pdbsum/3byz PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3byz ProSAT]</span></td></tr>
</table>
== Disease ==
[https://www.uniprot.org/uniprot/DHI1_HUMAN DHI1_HUMAN] Defects in HSD11B1 are a cause of cortisone reductase deficiency (CRD) [MIM:[https://omim.org/entry/604931 604931]. In CRD, activation of cortisone to cortisol does not occur, resulting in adrenocorticotropin-mediated androgen excess and a phenotype resembling polycystic ovary syndrome (PCOS).
== Function ==
[https://www.uniprot.org/uniprot/DHI1_HUMAN DHI1_HUMAN] Catalyzes reversibly the conversion of cortisol to the inactive metabolite cortisone. Catalyzes reversibly the conversion of 7-ketocholesterol to 7-beta-hydroxycholesterol. In intact cells, the reaction runs only in one direction, from 7-ketocholesterol to 7-beta-hydroxycholesterol (By similarity).
== Evolutionary Conservation ==
[[Image:Consurf_key_small.gif|200px|right]]
Check<jmol>
  <jmolCheckbox>
    <scriptWhenChecked>; select protein; define ~consurf_to_do selected; consurf_initial_scene = true; script "/wiki/ConSurf/by/3byz_consurf.spt"</scriptWhenChecked>
    <scriptWhenUnchecked>script /wiki/extensions/Proteopedia/spt/initialview01.spt</scriptWhenUnchecked>
    <text>to colour the structure by Evolutionary Conservation</text>
  </jmolCheckbox>
</jmol>, as determined by [http://consurfdb.tau.ac.il/ ConSurfDB]. You may read the [[Conservation%2C_Evolutionary|explanation]] of the method and the full data available from [http://bental.tau.ac.il/new_ConSurfDB/main_output.php?pdb_ID=3byz ConSurf].
<div style="clear:both"></div>
 
==See Also==
*[[Hydroxysteroid dehydrogenase 3D structures|Hydroxysteroid dehydrogenase 3D structures]]
__TOC__
</StructureSection>
[[Category: Homo sapiens]]
[[Category: Homo sapiens]]
[[Category: Single protein]]
[[Category: Large Structures]]
[[Category: Jordan, S R.]]
[[Category: Jordan SR]]
[[Category: Li, V.]]
[[Category: Li V]]
[[Category: Zhang, J.]]
[[Category: Zhang J]]
[[Category: H11]]
[[Category: NDP]]
[[Category: ----]]
[[Category: 3-layer (aba) sandwich]]
[[Category: alpha beta]]
[[Category: endoplasmic reticulum]]
[[Category: glycoprotein]]
[[Category: lipid metabolism]]
[[Category: membrane]]
[[Category: microsome]]
[[Category: nad(p)-binding rossmann-like domain. amino thiazole inhibitor]]
[[Category: nadp]]
[[Category: oxidoreductase]]
[[Category: polymorphism]]
[[Category: rossmann fold]]
[[Category: signal-anchor]]
[[Category: steroid metabolism]]
[[Category: transmembrane]]
 
''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 19:07:59 2008''

Latest revision as of 09:31, 21 February 2024

2-Amino-1,3-thiazol-4(5H)-ones as Potent and Selective 11-Hydroxysteroid Dehydrogenase Type 1 Inhibitors

3byz, resolution 2.69Å

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