5emh
From Proteopedia
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==Crystal structure of Iridoid Synthase from Cantharanthus roseus in complex with NADP+== | ==Crystal structure of Iridoid Synthase from Cantharanthus roseus in complex with NADP+== | ||
| - | <StructureSection load='5emh' size='340' side='right' caption='[[5emh]], [[Resolution|resolution]] 2.10Å' scene=''> | + | <StructureSection load='5emh' size='340' side='right'caption='[[5emh]], [[Resolution|resolution]] 2.10Å' scene=''> |
== Structural highlights == | == Structural highlights == | ||
| - | <table><tr><td colspan='2'>[[5emh]] is a 1 chain structure with sequence from [ | + | <table><tr><td colspan='2'>[[5emh]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Catharanthus_roseus Catharanthus roseus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=5EMH OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=5EMH FirstGlance]. <br> |
| - | </td></tr><tr id=' | + | </td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 2.1Å</td></tr> |
| - | <tr id=' | + | <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></td></tr> |
| - | <tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[ | + | <tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=5emh FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=5emh OCA], [https://pdbe.org/5emh PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=5emh RCSB], [https://www.ebi.ac.uk/pdbsum/5emh PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=5emh ProSAT]</span></td></tr> |
</table> | </table> | ||
| + | == Function == | ||
| + | [https://www.uniprot.org/uniprot/IRIS_CATRO IRIS_CATRO] | ||
| + | <div style="background-color:#fffaf0;"> | ||
| + | == Publication Abstract from PubMed == | ||
| + | Iridoid synthases belong to the family of short-chain dehydrogenase/reductase involved in the biosynthesis of iridoids. Despite having high sequence and structural homology with progesterone 5beta-reductase, these enzymes exhibit differential substrate specificities. Previously, two loops, L1 and L2 at substrate-binding pocket, were suggested to be involved in generating substrate specificity. However, the structural basis of specificity determinants was elusive. Here, combining sequence and structural analysis, site-directed mutagenesis, and molecular dynamics simulations, we have shown that iridoid synthase contains two channels for substrate entry whose geometries are altered by L1-L2 dynamics, primarily orchestrated by interactions of residues Glu161 and Gly162 of L1 and Asn358 of L2. A complex interplay of these interactions confer the substrate specificity to the enzyme. | ||
| + | |||
| + | Dynamics of loops at the substrate entry channel determine the specificity of iridoid synthases.,Sandholu AS, Mohole M, Duax WL, Thulasiram HV, Sengupta D, Kulkarni K FEBS Lett. 2018 Aug;592(15):2624-2635. doi: 10.1002/1873-3468.13174. Epub 2018, Jul 10. PMID:29944733<ref>PMID:29944733</ref> | ||
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| + | From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br> | ||
| + | </div> | ||
| + | <div class="pdbe-citations 5emh" style="background-color:#fffaf0;"></div> | ||
| + | == References == | ||
| + | <references/> | ||
__TOC__ | __TOC__ | ||
</StructureSection> | </StructureSection> | ||
| - | [[Category: | + | [[Category: Catharanthus roseus]] |
| - | [[Category: | + | [[Category: Large Structures]] |
| - | [[Category: Kulkarni | + | [[Category: Kulkarni KA]] |
| - | [[Category: Sandholu | + | [[Category: Sandholu A]] |
| - | [[Category: Thulasiram | + | [[Category: Thulasiram HV]] |
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Current revision
Crystal structure of Iridoid Synthase from Cantharanthus roseus in complex with NADP+
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