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3byz

From Proteopedia

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[[Image:3byz.jpg|left|200px]]
 
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{{Structure
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==2-Amino-1,3-thiazol-4(5H)-ones as Potent and Selective 11-Hydroxysteroid Dehydrogenase Type 1 Inhibitors==
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|PDB= 3byz |SIZE=350|CAPTION= <scene name='initialview01'>3byz</scene>, resolution 2.69&Aring;
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<StructureSection load='3byz' size='340' side='right'caption='[[3byz]], [[Resolution|resolution]] 2.69&Aring;' scene=''>
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|SITE= <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>
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== Structural highlights ==
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|LIGAND= <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>
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<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>
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|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>
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</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>
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|GENE= HSD11B1, HSD11, HSD11L ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 Homo sapiens])
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<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>
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|DOMAIN=
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<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>
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|RELATEDENTRY=[[2rbe|2RBE]]
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</table>
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3byz FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3byz OCA], [http://www.ebi.ac.uk/pdbsum/3byz PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=3byz RCSB]</span>
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== Disease ==
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}}
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[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).
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== Function ==
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[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).
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== Evolutionary Conservation ==
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[[Image:Consurf_key_small.gif|200px|right]]
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Check<jmol>
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<jmolCheckbox>
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<scriptWhenChecked>; select protein; define ~consurf_to_do selected; consurf_initial_scene = true; script "/wiki/ConSurf/by/3byz_consurf.spt"</scriptWhenChecked>
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<scriptWhenUnchecked>script /wiki/extensions/Proteopedia/spt/initialview01.spt</scriptWhenUnchecked>
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<text>to colour the structure by Evolutionary Conservation</text>
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</jmolCheckbox>
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</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].
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<div style="clear:both"></div>
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'''2-Amino-1,3-thiazol-4(5H)-ones as Potent and Selective 11-Hydroxysteroid Dehydrogenase Type 1 Inhibitors'''
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==See Also==
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*[[Hydroxysteroid dehydrogenase 3D structures|Hydroxysteroid dehydrogenase 3D structures]]
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__TOC__
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==About this Structure==
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</StructureSection>
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3BYZ is a [[Single protein]] structure of sequence from [http://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].
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[[Category: 11-beta-hydroxysteroid dehydrogenase]]
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[[Category: Homo sapiens]]
[[Category: Homo sapiens]]
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[[Category: Single protein]]
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[[Category: Large Structures]]
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[[Category: Jordan, S R.]]
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[[Category: Jordan SR]]
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[[Category: Li, V.]]
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[[Category: Li V]]
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[[Category: Zhang, J.]]
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[[Category: Zhang J]]
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[[Category: 3-layer (aba) sandwich]]
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[[Category: alpha beta]]
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[[Category: endoplasmic reticulum]]
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[[Category: glycoprotein]]
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[[Category: lipid metabolism]]
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[[Category: membrane]]
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[[Category: microsome]]
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[[Category: nad(p)-binding rossmann-like domain. amino thiazole inhibitor]]
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[[Category: nadp]]
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[[Category: oxidoreductase]]
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[[Category: polymorphism]]
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[[Category: rossmann fold]]
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[[Category: signal-anchor]]
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[[Category: steroid metabolism]]
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[[Category: transmembrane]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 05:29:46 2008''
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Current revision

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

PDB ID 3byz

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