1het

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[[Image:1het.png|left|200px]]
 
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==atomic X-ray structure of liver alcohol dehydrogenase containing a hydroxide adduct to NADH==
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The line below this paragraph, containing "STRUCTURE_1het", creates the "Structure Box" on the page.
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<StructureSection load='1het' size='340' side='right'caption='[[1het]], [[Resolution|resolution]] 1.15&Aring;' scene=''>
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You may change the PDB parameter (which sets the PDB file loaded into the applet)
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== Structural highlights ==
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or the SCENE parameter (which sets the initial scene displayed when the page is loaded),
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<table><tr><td colspan='2'>[[1het]] is a 2 chain structure with sequence from [https://en.wikipedia.org/wiki/Equus_caballus Equus caballus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1HET OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=1HET FirstGlance]. <br>
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or leave the SCENE parameter empty for the default display.
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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]] 1.15&#8491;</td></tr>
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<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=MRD:(4R)-2-METHYLPENTANE-2,4-DIOL'>MRD</scene>, <scene name='pdbligand=NAD:NICOTINAMIDE-ADENINE-DINUCLEOTIDE'>NAD</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
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{{STRUCTURE_1het| PDB=1het | SCENE= }}
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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=1het FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=1het OCA], [https://pdbe.org/1het PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=1het RCSB], [https://www.ebi.ac.uk/pdbsum/1het PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=1het ProSAT]</span></td></tr>
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</table>
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== Function ==
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[https://www.uniprot.org/uniprot/ADH1E_HORSE ADH1E_HORSE]
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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/he/1het_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=1het ConSurf].
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<div style="clear:both"></div>
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<div style="background-color:#fffaf0;">
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== Publication Abstract from PubMed ==
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Atomic (1 A) resolution x-ray structures of horse liver alcohol dehydrogenase in complex with NADH revealed the formation of an adduct in the active site between a metal-bound water and NADH. Furthermore, a pronounced distortion of the pyridine ring of NADH was observed. A series of quantum chemical calculations on the water-nicotinamide adduct showed that the puckering of the pyridine ring in the crystal structures can only be reproduced when the water is considered a hydroxide ion. These observations provide fundamental insight into the enzymatic activation of NADH for hydride transfer.
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===ATOMIC X-RAY STRUCTURE OF LIVER ALCOHOL DEHYDROGENASE CONTAINING A HYDROXIDE ADDUCT TO NADH===
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On the enzymatic activation of NADH.,Meijers R, Morris RJ, Adolph HW, Merli A, Lamzin VS, Cedergren-Zeppezauer ES J Biol Chem. 2001 Mar 23;276(12):9316-21. Epub 2000 Dec 28. PMID:11134046<ref>PMID:11134046</ref>
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
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</div>
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<div class="pdbe-citations 1het" style="background-color:#fffaf0;"></div>
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==See Also==
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The line below this paragraph, {{ABSTRACT_PUBMED_11134046}}, adds the Publication Abstract to the page
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*[[Alcohol dehydrogenase 3D structures|Alcohol dehydrogenase 3D structures]]
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(as it appears on PubMed at http://www.pubmed.gov), where 11134046 is the PubMed ID number.
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== References ==
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<references/>
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{{ABSTRACT_PUBMED_11134046}}
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__TOC__
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</StructureSection>
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==About this Structure==
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[[1het]] is a 2 chain structure with sequence from [http://en.wikipedia.org/wiki/Equus_caballus Equus caballus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1HET OCA].
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==Reference==
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<ref group="xtra">PMID:11134046</ref><ref group="xtra">PMID:10529241</ref><ref group="xtra">PMID:9220961</ref><ref group="xtra">PMID:15299812</ref><ref group="xtra">PMID:15299346</ref><ref group="xtra">PMID:3771574</ref><ref group="xtra">PMID:6098306</ref><ref group="xtra">PMID:6351056</ref><ref group="xtra">PMID:6362718</ref><ref group="xtra">PMID:6753930</ref><ref group="xtra">PMID:178875</ref><ref group="xtra">PMID:4365379</ref><references group="xtra"/>
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[[Category: Alcohol dehydrogenase]]
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[[Category: Equus caballus]]
[[Category: Equus caballus]]
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[[Category: Adolph, H W.]]
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[[Category: Large Structures]]
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[[Category: Cedergen-Zeppezauer, E S.]]
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[[Category: Adolph HW]]
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[[Category: Lamzin, V S.]]
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[[Category: Cedergen-Zeppezauer ES]]
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[[Category: Meijers, R.]]
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[[Category: Lamzin VS]]
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[[Category: Merli, A.]]
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[[Category: Meijers R]]
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[[Category: Morris, R J.]]
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[[Category: Merli A]]
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[[Category: Oxidoreductase]]
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[[Category: Morris RJ]]

Current revision

atomic X-ray structure of liver alcohol dehydrogenase containing a hydroxide adduct to NADH

PDB ID 1het

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