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4ufz

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<StructureSection load='4ufz' size='340' side='right'caption='[[4ufz]], [[Resolution|resolution]] 2.33&Aring;' scene=''>
<StructureSection load='4ufz' size='340' side='right'caption='[[4ufz]], [[Resolution|resolution]] 2.33&Aring;' scene=''>
== Structural highlights ==
== Structural highlights ==
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<table><tr><td colspan='2'>[[4ufz]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/"bacterium_influenzae"_lehmann_and_neumann_1896 "bacterium influenzae" lehmann and neumann 1896]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4UFZ OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4UFZ FirstGlance]. <br>
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<table><tr><td colspan='2'>[[4ufz]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Haemophilus_influenzae Haemophilus influenzae]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4UFZ OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4UFZ 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=IA7:5,7-BIS(AZANYL)-2-TERT-BUTYL-4-(1,3-THIAZOL-2-YL)PYRIDO[2,3-D]PYRIMIDINE-6-CARBONITRILE'>IA7</scene>, <scene name='pdbligand=IWH:1-(2,4-DIMETHYLBENZYL)-6-OXO-1,6-DIHYDROPYRIDINE-3-CARBOXAMIDE'>IWH</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=IA7:5,7-BIS(AZANYL)-2-TERT-BUTYL-4-(1,3-THIAZOL-2-YL)PYRIDO[2,3-D]PYRIMIDINE-6-CARBONITRILE'>IA7</scene>, <scene name='pdbligand=IWH:1-(2,4-DIMETHYLBENZYL)-6-OXO-1,6-DIHYDROPYRIDINE-3-CARBOXAMIDE'>IWH</scene></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/DNA_ligase_(NAD(+)) DNA ligase (NAD(+))], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=6.5.1.2 6.5.1.2] </span></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=4ufz FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4ufz OCA], [https://pdbe.org/4ufz PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4ufz RCSB], [https://www.ebi.ac.uk/pdbsum/4ufz PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4ufz 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=4ufz FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4ufz OCA], [http://pdbe.org/4ufz PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=4ufz RCSB], [http://www.ebi.ac.uk/pdbsum/4ufz PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=4ufz ProSAT]</span></td></tr>
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</table>
</table>
== Function ==
== Function ==
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[[http://www.uniprot.org/uniprot/DNLJ_HAEIN DNLJ_HAEIN]] DNA ligase that catalyzes the formation of phosphodiester linkages between 5'-phosphoryl and 3'-hydroxyl groups in double-stranded DNA using NAD as a coenzyme and as the energy source for the reaction. It is essential for DNA replication and repair of damaged DNA (By similarity).
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[https://www.uniprot.org/uniprot/DNLJ_HAEIN DNLJ_HAEIN] DNA ligase that catalyzes the formation of phosphodiester linkages between 5'-phosphoryl and 3'-hydroxyl groups in double-stranded DNA using NAD as a coenzyme and as the energy source for the reaction. It is essential for DNA replication and repair of damaged DNA (By similarity).
<div style="background-color:#fffaf0;">
<div style="background-color:#fffaf0;">
== Publication Abstract from PubMed ==
== Publication Abstract from PubMed ==
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__TOC__
__TOC__
</StructureSection>
</StructureSection>
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[[Category: Bacterium influenzae lehmann and neumann 1896]]
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[[Category: Haemophilus influenzae]]
[[Category: Large Structures]]
[[Category: Large Structures]]
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[[Category: Boriack-Sjodin, P A]]
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[[Category: Boriack-Sjodin PA]]
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[[Category: Carcanague, D]]
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[[Category: Carcanague D]]
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[[Category: Gingipali, L]]
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[[Category: Gingipali L]]
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[[Category: Gowravaram, M]]
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[[Category: Gowravaram M]]
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[[Category: Hale, M]]
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[[Category: Hale M]]
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[[Category: Harang, J]]
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[[Category: Harang J]]
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[[Category: Ioannidis, G]]
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[[Category: Ioannidis G]]
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[[Category: Jahic, H]]
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[[Category: Jahic H]]
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[[Category: Johnstone, M]]
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[[Category: Johnstone M]]
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[[Category: Kutschke, A]]
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[[Category: Kutschke A]]
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[[Category: Laganas, V A]]
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[[Category: Laganas VA]]
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[[Category: Loch, J]]
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[[Category: Loch J]]
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[[Category: Martinez-Botella, G]]
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[[Category: Martinez-Botella G]]
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[[Category: Murphy-Benenato, K E]]
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[[Category: Murphy-Benenato KE]]
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[[Category: Oguto, H]]
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[[Category: Oguto H]]
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[[Category: Patel, S J]]
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[[Category: Patel SJ]]
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[[Category: Ligase]]
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Revision as of 08:22, 22 March 2023

Synthesis of Novel NAD Dependant DNA Ligase Inhibitors via Negishi Cross-Coupling: Development of SAR and Resistance Studies

PDB ID 4ufz

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OCA

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