5m4n

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==Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase==
==Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase==
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<StructureSection load='5m4n' size='340' side='right' caption='[[5m4n]], [[Resolution|resolution]] 2.60&Aring;' scene=''>
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<StructureSection load='5m4n' size='340' side='right'caption='[[5m4n]], [[Resolution|resolution]] 2.60&Aring;' scene=''>
== Structural highlights ==
== Structural highlights ==
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<table><tr><td colspan='2'>[[5m4n]] is a 1 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=5M4N OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5M4N FirstGlance]. <br>
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<table><tr><td colspan='2'>[[5m4n]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=5M4N OCA]. For a <b>guided tour on the structure components</b> use [http://proteopedia.org/fgij/fg.htm?mol=5M4N 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=7FV:[2,4-BIS(OXIDANYL)PHENYL]-[(2~{S})-2-METHYL-6-(3-METHYLQUINOLIN-2-YL)-3,4-DIHYDRO-2~{H}-QUINOLIN-1-YL]METHANONE'>7FV</scene>, <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=TF3:N-(2-AMINOETHYL)-2-{3-CHLORO-4-[(4-ISOPROPYLBENZYL)OXY]PHENYL}+ACETAMIDE'>TF3</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=7FV:[2,4-BIS(OXIDANYL)PHENYL]-[(2~{S})-2-METHYL-6-(3-METHYLQUINOLIN-2-YL)-3,4-DIHYDRO-2~{H}-QUINOLIN-1-YL]METHANONE'>7FV</scene>, <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=TF3:N-(2-AMINOETHYL)-2-{3-CHLORO-4-[(4-ISOPROPYLBENZYL)OXY]PHENYL}+ACETAMIDE'>TF3</scene></td></tr>
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<tr id='gene'><td class="sblockLbl"><b>[[Gene|Gene:]]</b></td><td class="sblockDat">PDK2, PDHK2 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 HUMAN])</td></tr>
<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/[Pyruvate_dehydrogenase_(acetyl-transferring)]_kinase [Pyruvate dehydrogenase (acetyl-transferring)] kinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.11.2 2.7.11.2] </span></td></tr>
<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/[Pyruvate_dehydrogenase_(acetyl-transferring)]_kinase [Pyruvate dehydrogenase (acetyl-transferring)] kinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.11.2 2.7.11.2] </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=5m4n FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=5m4n OCA], [http://pdbe.org/5m4n PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=5m4n RCSB], [http://www.ebi.ac.uk/pdbsum/5m4n PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=5m4n 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://proteopedia.org/fgij/fg.htm?mol=5m4n FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=5m4n OCA], [http://pdbe.org/5m4n PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=5m4n RCSB], [http://www.ebi.ac.uk/pdbsum/5m4n PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=5m4n ProSAT]</span></td></tr>
</table>
</table>
== Function ==
== Function ==
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</div>
</div>
<div class="pdbe-citations 5m4n" style="background-color:#fffaf0;"></div>
<div class="pdbe-citations 5m4n" style="background-color:#fffaf0;"></div>
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==See Also==
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*[[Pyruvate dehydrogenase kinase|Pyruvate dehydrogenase kinase]]
== References ==
== References ==
<references/>
<references/>
__TOC__
__TOC__
</StructureSection>
</StructureSection>
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[[Category: Human]]
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[[Category: Large Structures]]
[[Category: Baker, L M]]
[[Category: Baker, L M]]
[[Category: Brough, P]]
[[Category: Brough, P]]

Revision as of 11:01, 12 August 2020

Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase

PDB ID 5m4n

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