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4cc5

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==Fragment-Based Discovery of 6 Azaindazoles As Inhibitors of Bacterial DNA Ligase==
==Fragment-Based Discovery of 6 Azaindazoles As Inhibitors of Bacterial DNA Ligase==
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<StructureSection load='4cc5' size='340' side='right' caption='[[4cc5]], [[Resolution|resolution]] 1.88&Aring;' scene=''>
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<StructureSection load='4cc5' size='340' side='right'caption='[[4cc5]], [[Resolution|resolution]] 1.88&Aring;' scene=''>
== Structural highlights ==
== Structural highlights ==
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<table><tr><td colspan='2'>[[4cc5]] is a 1 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4CC5 OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4CC5 FirstGlance]. <br>
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<table><tr><td colspan='2'>[[4cc5]] 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=4CC5 OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4CC5 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=L5V:2-CHLORANYL-6-(1H-1,2,4-TRIAZOL-3-YL)PYRAZINE'>L5V</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</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]] 1.88&#8491;</td></tr>
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<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[4cc6|4cc6]]</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=L5V:2-CHLORANYL-6-(1H-1,2,4-TRIAZOL-3-YL)PYRAZINE'>L5V</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</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=4cc5 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4cc5 OCA], [https://pdbe.org/4cc5 PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4cc5 RCSB], [https://www.ebi.ac.uk/pdbsum/4cc5 PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4cc5 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=4cc5 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4cc5 OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4cc5 RCSB], [http://www.ebi.ac.uk/pdbsum/4cc5 PDBsum]</span></td></tr>
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</table>
</table>
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== Function ==
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[https://www.uniprot.org/uniprot/DNLJ_STAAU DNLJ_STAAU]
<div style="background-color:#fffaf0;">
<div style="background-color:#fffaf0;">
== Publication Abstract from PubMed ==
== Publication Abstract from PubMed ==
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
</div>
</div>
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<div class="pdbe-citations 4cc5" style="background-color:#fffaf0;"></div>
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==See Also==
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*[[DNA ligase 3D structures|DNA ligase 3D structures]]
== References ==
== References ==
<references/>
<references/>
__TOC__
__TOC__
</StructureSection>
</StructureSection>
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[[Category: Amin, N]]
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[[Category: Large Structures]]
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[[Category: Benowitz, A B]]
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[[Category: Staphylococcus aureus]]
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[[Category: Chiarparin, E]]
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[[Category: Amin N]]
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[[Category: Cui, H]]
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[[Category: Benowitz AB]]
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[[Category: Deng, X]]
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[[Category: Chiarparin E]]
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[[Category: Heightman, T D]]
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[[Category: Cui H]]
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[[Category: Holmes, D J]]
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[[Category: Deng X]]
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[[Category: Hopkins, A]]
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[[Category: Heightman TD]]
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[[Category: Howard, S]]
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[[Category: Holmes DJ]]
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[[Category: Huang, J]]
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[[Category: Hopkins A]]
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[[Category: Jin, Q]]
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[[Category: Howard S]]
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[[Category: Kreatsoulas, C]]
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[[Category: Huang J]]
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[[Category: Martin, A C.L]]
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[[Category: Jin Q]]
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[[Category: Massey, F]]
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[[Category: Kreatsoulas C]]
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[[Category: McCloskey, L]]
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[[Category: Martin ACL]]
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[[Category: Mortenson, P N]]
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[[Category: Massey F]]
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[[Category: Pathuri, P]]
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[[Category: McCloskey L]]
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[[Category: Tisi, D]]
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[[Category: Mortenson PN]]
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[[Category: Williams, P A]]
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[[Category: Pathuri P]]
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[[Category: Antibiotic design]]
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[[Category: Tisi D]]
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[[Category: Ligase]]
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[[Category: Williams PA]]

Current revision

Fragment-Based Discovery of 6 Azaindazoles As Inhibitors of Bacterial DNA Ligase

PDB ID 4cc5

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