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3tfv

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==Crystal structure of dehydrosqualene synthase (crtm) from s. aureus complexed with bph-1154==
==Crystal structure of dehydrosqualene synthase (crtm) from s. aureus complexed with bph-1154==
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<StructureSection load='3tfv' size='340' side='right' caption='[[3tfv]], [[Resolution|resolution]] 3.00&Aring;' scene=''>
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<StructureSection load='3tfv' size='340' side='right'caption='[[3tfv]], [[Resolution|resolution]] 3.00&Aring;' scene=''>
== Structural highlights ==
== Structural highlights ==
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<table><tr><td colspan='2'>[[3tfv]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Staphylococcus_aureus Staphylococcus aureus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3TFV OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3TFV FirstGlance]. <br>
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<table><tr><td colspan='2'>[[3tfv]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Staphylococcus_aureus Staphylococcus aureus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3TFV OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3TFV 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=2CN:5-BROMO-2-{[3-(OCTYLOXY)BENZYL]SULFANYL}BENZOIC+ACID'>2CN</scene>, <scene name='pdbligand=MG:MAGNESIUM+ION'>MG</scene></td></tr>
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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]] 3&#8491;</td></tr>
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<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[3tfp|3tfp]], [[3tfn|3tfn]]</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=2CN:5-BROMO-2-{[3-(OCTYLOXY)BENZYL]SULFANYL}BENZOIC+ACID'>2CN</scene>, <scene name='pdbligand=MG:MAGNESIUM+ION'>MG</scene></td></tr>
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<tr id='gene'><td class="sblockLbl"><b>[[Gene|Gene:]]</b></td><td class="sblockDat">crtM ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=1280 Staphylococcus aureus])</td></tr>
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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=3tfv FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3tfv OCA], [https://pdbe.org/3tfv PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3tfv RCSB], [https://www.ebi.ac.uk/pdbsum/3tfv PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3tfv ProSAT]</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=3tfv FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3tfv OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3tfv RCSB], [http://www.ebi.ac.uk/pdbsum/3tfv PDBsum]</span></td></tr>
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</table>
</table>
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<div style="background-color:#fffaf0;">
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== Function ==
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== Publication Abstract from PubMed ==
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[https://www.uniprot.org/uniprot/CRTM_STAAU CRTM_STAAU]
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Double whammy! Small molecules that inhibit Staphylococcus aureus dehydrosqualene synthase (CrtM) or host squalene synthase (SQS) are of interest as novel, innate immunity-based therapeutics, blocking virulence or stimulating antibacterial neutrophil extracellular trap (NET) formation. The discovery of leads that do both represents a new route to treating staph infections.
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Dual dehydrosqualene/squalene synthase inhibitors: leads for innate immune system-based therapeutics.,Lin FY, Zhang Y, Hensler M, Liu YL, Chow OA, Zhu W, Wang K, Pang R, Thienphrapa W, Nizet V, Oldfield E ChemMedChem. 2012 Apr;7(4):561-4. doi: 10.1002/cmdc.201100589. Epub 2012 Jan 30. PMID:22290830<ref>PMID:22290830</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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==See Also==
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</div>
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*[[Squalene synthase|Squalene synthase]]
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== References ==
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<references/>
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__TOC__
__TOC__
</StructureSection>
</StructureSection>
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[[Category: Large Structures]]
[[Category: Staphylococcus aureus]]
[[Category: Staphylococcus aureus]]
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[[Category: Lin, F Y]]
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[[Category: Lin F-Y]]
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[[Category: Liu, Y L]]
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[[Category: Liu Y-L]]
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[[Category: Oldfield, E]]
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[[Category: Oldfield E]]
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[[Category: Zhang, Y]]
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[[Category: Zhang Y]]
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[[Category: Head to head prenyl synthase]]
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[[Category: Transferase-transferase inhibitor complex]]
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Current revision

Crystal structure of dehydrosqualene synthase (crtm) from s. aureus complexed with bph-1154

PDB ID 3tfv

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