4ciw
From Proteopedia
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==Crystal structure of Mycobacterium tuberculosis type 2 dehydroquinase in complex with (1R,4R,5R)-1,4,5-trihydroxy-3-(2-hydroxy)ethylcyclohex-2-ene-1-carboxylic acid== | ==Crystal structure of Mycobacterium tuberculosis type 2 dehydroquinase in complex with (1R,4R,5R)-1,4,5-trihydroxy-3-(2-hydroxy)ethylcyclohex-2-ene-1-carboxylic acid== | ||
| - | <StructureSection load='4ciw' size='340' side='right' caption='[[4ciw]], [[Resolution|resolution]] 2.20Å' scene=''> | + | <StructureSection load='4ciw' size='340' side='right'caption='[[4ciw]], [[Resolution|resolution]] 2.20Å' scene=''> |
== Structural highlights == | == Structural highlights == | ||
| - | <table><tr><td colspan='2'>[[4ciw]] is a 1 chain structure with sequence from [ | + | <table><tr><td colspan='2'>[[4ciw]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Mycobacterium_tuberculosis Mycobacterium tuberculosis]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4CIW OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4CIW FirstGlance]. <br> |
| - | </td></tr><tr><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=NA:SODIUM+ION'>NA</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</scene>, <scene name='pdbligand=XH2:(1R,4R,5R)-1,4,5-TRIHYDROXY-3-(2-HYDROXY)ETHYLCYCLOHEX-2-ENE-1-CARBOXYLIC+ACID'>XH2</scene | + | </td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 2.2Å</td></tr> |
| - | + | <tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=NA:SODIUM+ION'>NA</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</scene>, <scene name='pdbligand=XH2:(1R,4R,5R)-1,4,5-TRIHYDROXY-3-(2-HYDROXY)ETHYLCYCLOHEX-2-ENE-1-CARBOXYLIC+ACID'>XH2</scene></td></tr> | |
| - | <tr | + | <tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4ciw FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4ciw OCA], [https://pdbe.org/4ciw PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4ciw RCSB], [https://www.ebi.ac.uk/pdbsum/4ciw PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4ciw ProSAT]</span></td></tr> |
| - | + | </table> | |
| - | <table> | + | == Function == |
| + | [https://www.uniprot.org/uniprot/AROQ_MYCTU AROQ_MYCTU] Catalyzes a trans-dehydration via an enolate intermediate (By similarity).[HAMAP-Rule:MF_00169] | ||
<div style="background-color:#fffaf0;"> | <div style="background-color:#fffaf0;"> | ||
== Publication Abstract from PubMed == | == Publication Abstract from PubMed == | ||
| Line 14: | Line 16: | ||
Exploring the Water-Binding Pocket of the Type II Dehydroquinase Enzyme in the Structure-Based Design of Inhibitors.,Blanco B, Sedes A, Peon A, Otero JM, Raaij MJ, Thompson P, Hawkins AR, Gonzalez-Bello C J Med Chem. 2014 Apr 1. PMID:24689821<ref>PMID:24689821</ref> | Exploring the Water-Binding Pocket of the Type II Dehydroquinase Enzyme in the Structure-Based Design of Inhibitors.,Blanco B, Sedes A, Peon A, Otero JM, Raaij MJ, Thompson P, Hawkins AR, Gonzalez-Bello C J Med Chem. 2014 Apr 1. PMID:24689821<ref>PMID:24689821</ref> | ||
| - | From | + | From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br> |
</div> | </div> | ||
| + | <div class="pdbe-citations 4ciw" style="background-color:#fffaf0;"></div> | ||
| + | |||
| + | ==See Also== | ||
| + | *[[Dehydroquinase 3D structures|Dehydroquinase 3D structures]] | ||
== References == | == References == | ||
<references/> | <references/> | ||
__TOC__ | __TOC__ | ||
</StructureSection> | </StructureSection> | ||
| - | [[Category: | + | [[Category: Large Structures]] |
| - | [[Category: Blanco | + | [[Category: Mycobacterium tuberculosis]] |
| - | [[Category: Gonzalez-Bello | + | [[Category: Blanco B]] |
| - | [[Category: Hawkins | + | [[Category: Gonzalez-Bello C]] |
| - | [[Category: Lamb | + | [[Category: Hawkins AR]] |
| - | [[Category: Llamas-Saiz | + | [[Category: Lamb H]] |
| - | [[Category: Otero | + | [[Category: Llamas-Saiz AL]] |
| - | [[Category: Peon | + | [[Category: Otero JM]] |
| - | + | [[Category: Peon A]] | |
| - | [[Category: Sedes | + | [[Category: Sedes A]] |
| - | [[Category: | + | [[Category: Van Raaij MJ]] |
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Current revision
Crystal structure of Mycobacterium tuberculosis type 2 dehydroquinase in complex with (1R,4R,5R)-1,4,5-trihydroxy-3-(2-hydroxy)ethylcyclohex-2-ene-1-carboxylic acid
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