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4em3

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Current revision (07:17, 28 September 2022) (edit) (undo)
 
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==Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor MeVS-CoA==
==Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor MeVS-CoA==
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<StructureSection load='4em3' size='340' side='right' caption='[[4em3]], [[Resolution|resolution]] 1.98&Aring;' scene=''>
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<StructureSection load='4em3' size='340' side='right'caption='[[4em3]], [[Resolution|resolution]] 1.98&Aring;' scene=''>
== Structural highlights ==
== Structural highlights ==
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<table><tr><td colspan='2'>[[4em3]] is a 2 chain structure with sequence from [http://en.wikipedia.org/wiki/Staa3 Staa3]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4EM3 OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4EM3 FirstGlance]. <br>
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<table><tr><td colspan='2'>[[4em3]] is a 2 chain structure with sequence from [https://en.wikipedia.org/wiki/Staphylococcus_aureus_subsp._aureus_USA300 Staphylococcus aureus subsp. aureus USA300]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4EM3 OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4EM3 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=CA6:[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]+[(3R)-2,2-dimethyl-4-[[3-(4-methylsulfonylbutylamino)-3-oxidanylidene-propyl]amino]-3-oxidanyl-4-oxidanylidene-butyl]+hydrogen+phosphate'>CA6</scene>, <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=MG:MAGNESIUM+ION'>MG</scene></td></tr>
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</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=CA6:[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]+[(3R)-2,2-dimethyl-4-[[3-(4-methylsulfonylbutylamino)-3-oxidanylidene-propyl]amino]-3-oxidanyl-4-oxidanylidene-butyl]+hydrogen+phosphate'>CA6</scene>, <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=MG:MAGNESIUM+ION'>MG</scene></td></tr>
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<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[1yqz|1yqz]], [[4em4|4em4]], [[4emw|4emw]], [[4eqr|4eqr]], [[4eqs|4eqs]], [[4eqw|4eqw]], [[4eqx|4eqx]]</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=4em3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4em3 OCA], [https://pdbe.org/4em3 PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4em3 RCSB], [https://www.ebi.ac.uk/pdbsum/4em3 PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4em3 ProSAT]</span></td></tr>
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<tr id='gene'><td class="sblockLbl"><b>[[Gene|Gene:]]</b></td><td class="sblockDat">cdr, SAOUHSC_00908, SAUSA300_0873 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=367830 STAA3])</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/CoA-disulfide_reductase CoA-disulfide reductase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.8.1.14 1.8.1.14] </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=4em3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4em3 OCA], [http://pdbe.org/4em3 PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=4em3 RCSB], [http://www.ebi.ac.uk/pdbsum/4em3 PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=4em3 ProSAT]</span></td></tr>
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</table>
</table>
== Function ==
== Function ==
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[[http://www.uniprot.org/uniprot/CDR_STAA3 CDR_STAA3]] Catalyzes specifically the NADPH-dependent reduction of coenzyme A disulfide.[HAMAP-Rule:MF_01608]
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[[https://www.uniprot.org/uniprot/CDR_STAA3 CDR_STAA3]] Catalyzes specifically the NADPH-dependent reduction of coenzyme A disulfide.[HAMAP-Rule:MF_01608]
<div style="background-color:#fffaf0;">
<div style="background-color:#fffaf0;">
== Publication Abstract from PubMed ==
== Publication Abstract from PubMed ==
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</div>
</div>
<div class="pdbe-citations 4em3" style="background-color:#fffaf0;"></div>
<div class="pdbe-citations 4em3" style="background-color:#fffaf0;"></div>
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==See Also==
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*[[Coenzyme A-Disulfide Reductase|Coenzyme A-Disulfide Reductase]]
== References ==
== References ==
<references/>
<references/>
__TOC__
__TOC__
</StructureSection>
</StructureSection>
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[[Category: CoA-disulfide reductase]]
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[[Category: Large Structures]]
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[[Category: Staa3]]
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[[Category: Staphylococcus aureus subsp. aureus USA300]]
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[[Category: Claiborne, A]]
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[[Category: Claiborne A]]
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[[Category: Edwards, J S]]
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[[Category: Edwards JS]]
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[[Category: Redinbo, M R]]
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[[Category: Redinbo MR]]
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[[Category: Wallace, B D]]
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[[Category: Wallace BD]]
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[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]
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Current revision

Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor MeVS-CoA

PDB ID 4em3

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