3rx3: Difference between revisions

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-{{STRUCTURE_3rx3|  PDB=3rx3  |  SCENE=  }}
-===Crystal Structure of Human Aldose Reductase Complexed with Sulindac===
-{{ABSTRACT_PUBMED_22155003}}
-==Function==
+==Crystal Structure of Human Aldose Reductase Complexed with Sulindac==
-[[http://www.uniprot.org/uniprot/ALDR_HUMAN ALDR_HUMAN]] Catalyzes the NADPH-dependent reduction of a wide variety of carbonyl-containing compounds to their corresponding alcohols with a broad range of catalytic efficiencies.
+<StructureSection load='3rx3' size='340' side='right'caption='[[3rx3]], [[Resolution|resolution]] 1.90&Aring;' scene=''>
+== Structural highlights ==
+<table><tr><td colspan='2'>[[3rx3]] is a 1 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=3RX3 OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3RX3 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]] 1.9&#8491;</td></tr>
+<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=NAP:NADP+NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NAP</scene>, <scene name='pdbligand=SUZ:[(1Z)-5-FLUORO-2-METHYL-1-{4-[METHYLSULFINYL]BENZYLIDENE}-1H-INDEN-3-YL]ACETIC+ACID'>SUZ</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=3rx3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3rx3 OCA], [https://pdbe.org/3rx3 PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3rx3 RCSB], [https://www.ebi.ac.uk/pdbsum/3rx3 PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3rx3 ProSAT]</span></td></tr>
+</table>
+== Function ==
+[https://www.uniprot.org/uniprot/ALDR_HUMAN ALDR_HUMAN] Catalyzes the NADPH-dependent reduction of a wide variety of carbonyl-containing compounds to their corresponding alcohols with a broad range of catalytic efficiencies.
+<div style="background-color:#fffaf0;">
+== Publication Abstract from PubMed ==
+Sulindac (SLD) exhibits both the highest inhibitory activity towards human aldose reductase (AR) among popular non-steroidal anti-inflammatory drugs and clear beneficial clinical effects on Type 2 diabetes. However, the molecular basis for these properties is unclear. Here, we report that SLD and its pharmacologically active/inactive metabolites, SLD sulfide and SLD sulfone, are equally effective as un-competitive inhibitors of AR in vitro. Crystallographic analysis reveals that pi-pi stacking favored by the distinct scaffold of SLDs is pivotal to their high AR inhibitory activities. These results also suggest that SLD sulfone could be a potent lead compound for AR inhibition in vivo.
-==About this Structure==
+The molecular basis for inhibition of sulindac and its metabolites towards human aldose reductase.,Zheng X, Zhang L, Zhai J, Chen Y, Luo H, Hu X FEBS Lett. 2012 Jan 2;586(1):55-9. Epub 2011 Dec 8. PMID:22155003<ref>PMID:22155003</ref>
-[[3rx3]] is a 1 chain structure with 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=3RX3 OCA].
+From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
+</div>
+<div class="pdbe-citations 3rx3" style="background-color:#fffaf0;"></div>
 ==See Also==
-*[[Aldose Reductase|Aldose Reductase]]
+*[[Aldose reductase 3D structures|Aldose reductase 3D structures]]
+== References ==
-==Reference==
+<references/>
-<ref group="xtra">PMID:022155003</ref><references group="xtra"/><references/>
+__TOC__
-[[Category: Aldehyde reductase]]
+</StructureSection>
 [[Category: Homo sapiens]]
-[[Category: Chen, J.]]
+[[Category: Large Structures]]
-[[Category: Hu, X.]]
+[[Category: Chen J]]
-[[Category: Luo, H.]]
+[[Category: Hu X]]
-[[Category: Zheng, X.]]
+[[Category: Luo H]]
-[[Category: Aldose reductase]]
+[[Category: Zheng X]]
-[[Category: Oxidoreductase]]