5fqc

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'''Unreleased structure'''
 
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The entry 5fqc is ON HOLD until Dec 08 2017
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==Crystal structure of the metallo-beta-lactamase VIM-2 with 2C==
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<StructureSection load='5fqc' size='340' side='right' caption='[[5fqc]], [[Resolution|resolution]] 1.45&Aring;' scene=''>
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== Structural highlights ==
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<table><tr><td colspan='2'>[[5fqc]] is a 2 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=5FQC OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5FQC FirstGlance]. <br>
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</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=DMS:DIMETHYL+SULFOXIDE'>DMS</scene>, <scene name='pdbligand=FMT:FORMIC+ACID'>FMT</scene>, <scene name='pdbligand=OK3:(R)-3-(4-(AMINOMETHYL)BENZAMIDO)-8-CARBOXY-2,2-DIHYDROXY-3,4-DIHYDRO-2H-BENZO[E][1,2]OXABORININ-2-UIDE'>OK3</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
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<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[5fq9|5fq9]]</td></tr>
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<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Beta-lactamase Beta-lactamase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=3.5.2.6 3.5.2.6] </span></td></tr>
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<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5fqc FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=5fqc OCA], [http://pdbe.org/5fqc PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=5fqc RCSB], [http://www.ebi.ac.uk/pdbsum/5fqc PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=5fqc ProSAT]</span></td></tr>
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</table>
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<div style="background-color:#fffaf0;">
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== Publication Abstract from PubMed ==
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beta-Lactamases enable resistance to almost all beta-lactam antibiotics. Pioneering work revealed that acyclic boronic acids can act as 'transition state analogue' inhibitors of nucleophilic serine enzymes, including serine-beta-lactamases. Here we report biochemical and biophysical analyses revealing that cyclic boronates potently inhibit both nucleophilic serine and zinc-dependent beta-lactamases by a mechanism involving mimicking of the common tetrahedral intermediate. Cyclic boronates also potently inhibit the non-essential penicillin-binding protein PBP 5 by the same mechanism of action. The results open the way for development of dual action inhibitors effective against both serine- and metallo-beta-lactamases, and which could also have antimicrobial activity through inhibition of PBPs.
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Authors: Brem, J., Cain, R., McDonough, M.A., Clifton, I.J., Fishwick, C.W.G., Schofield, C.J.
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Structural basis of metallo-beta-lactamase, serine-beta-lactamase and penicillin-binding protein inhibition by cyclic boronates.,Brem J, Cain R, Cahill S, McDonough MA, Clifton IJ, Jimenez-Castellanos JC, Avison MB, Spencer J, Fishwick CW, Schofield CJ Nat Commun. 2016 Aug 8;7:12406. doi: 10.1038/ncomms12406. PMID:27499424<ref>PMID:27499424</ref>
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Description: Crystal structure of the metallo-beta-lactamase VIM-2 with 2C
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
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[[Category: Unreleased Structures]]
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</div>
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[[Category: Clifton, I.J]]
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<div class="pdbe-citations 5fqc" style="background-color:#fffaf0;"></div>
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[[Category: Mcdonough, M.A]]
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== References ==
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[[Category: Fishwick, C.W.G]]
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<references/>
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[[Category: Cain, R]]
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__TOC__
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[[Category: Schofield, C.J]]
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</StructureSection>
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[[Category: Beta-lactamase]]
[[Category: Brem, J]]
[[Category: Brem, J]]
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[[Category: Cain, R]]
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[[Category: Clifton, I J]]
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[[Category: Fishwick, C W.G]]
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[[Category: McDonough, M A]]
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[[Category: Schofield, C J]]
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[[Category: Antibiotic resistance]]
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[[Category: Hydrolase]]

Revision as of 00:02, 10 September 2016

Crystal structure of the metallo-beta-lactamase VIM-2 with 2C

5fqc, resolution 1.45Å

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