3wnq: Difference between revisions

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-'''Unreleased structure'''
+==Crystal structure of (R)-carbonyl reductase H49A mutant from Candida Parapsilosis in complex with 2-hydroxyacetophenone==
+<StructureSection load='3wnq' size='340' side='right' caption='[[3wnq]], [[Resolution|resolution]] 2.95&Aring;' scene=''>
+== Structural highlights ==
+<table><tr><td colspan='2'>[[3wnq]] is a 4 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3WNQ OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3WNQ FirstGlance]. <br>
+</td></tr><tr><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=HXT:2-HYDROXY-1-PHENYLETHANONE'>HXT</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene><br>
+<tr><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Alcohol_dehydrogenase Alcohol dehydrogenase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.1.1.1 1.1.1.1] </span></td></tr>
+<tr><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3wnq FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3wnq OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3wnq RCSB], [http://www.ebi.ac.uk/pdbsum/3wnq PDBsum]</span></td></tr>
+<table>
+<div style="background-color:#fffaf0;">
+== Publication Abstract from PubMed ==
+Structure-guided design of substrate-binding pocket inversed the stereoselectivity of an NADH-dependent medium-chain alcohol dehydrogenase (MDR) from Prelog to anti-Prelog. The pocket-forming amino acids, especially the unconserved residues as hotspots, play critical roles in directing MDRs' stereoselectivity.
-The entry 3wnq is ON HOLD  until Paper Publication
+Unconserved substrate-binding sites direct the stereoselectivity of medium-chain alcohol dehydrogenase.,Wang S, Nie Y, Xu Y, Zhang R, Ko TP, Huang CH, Chan HC, Guo RT, Xiao R Chem Commun (Camb). 2014 Jun 24;50(58):7770-2. doi: 10.1039/c4cc01752h. PMID:24834985<ref>PMID:24834985</ref>
-Authors: Wang, S.S., Nie, Y., Xu, Y., Zhang, R.Z., Huang, C.H., Chan, H.C., Guo, R.T., Ko, T.P., Xiao, R.
+From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
+</div>
-Description: complex structure of (R)-carbonyl reductase H49A with 2-hydroxyacetophenone
+== References ==
+<references/>
+__TOC__
+</StructureSection>
+[[Category: Alcohol dehydrogenase]]
+[[Category: Chan, H C.]]
+[[Category: Guo, R T.]]
+[[Category: Huang, C H.]]
+[[Category: Ko, T P.]]
+[[Category: Nie, Y.]]
+[[Category: Wang, S S.]]
+[[Category: Xiao, R.]]
+[[Category: Xu, Y.]]
+[[Category: Zhang, R Z.]]
+[[Category: Alcohol dehydrogenase]]
+[[Category: Carbonyl reductase]]
+[[Category: Oxidoreductase]]