2ydk: Difference between revisions
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==Discovery of Checkpoint Kinase Inhibitor AZD7762 by Structure Based Design and Optimization of Thiophene Carboxamide Ureas== | ==Discovery of Checkpoint Kinase Inhibitor AZD7762 by Structure Based Design and Optimization of Thiophene Carboxamide Ureas== | ||
<StructureSection load='2ydk' size='340' side='right' caption='[[2ydk]], [[Resolution|resolution]] 1.90Å' scene=''> | <StructureSection load='2ydk' size='340' side='right' caption='[[2ydk]], [[Resolution|resolution]] 1.90Å' scene=''> | ||
== Structural highlights == | == Structural highlights == | ||
<table><tr><td colspan='2'>[[2ydk]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/ | <table><tr><td colspan='2'>[[2ydk]] 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=2YDK OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2YDK FirstGlance]. <br> | ||
</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=GOL:GLYCEROL'>GOL</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</scene>, <scene name='pdbligand=YDK:2-(CARBAMOYLAMINO)-5-PHENYL-N-[(3S)-PIPERIDIN-3-YL]THIOPHENE-3-CARBOXAMIDE'>YDK</scene></td></tr> | </td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=GOL:GLYCEROL'>GOL</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</scene>, <scene name='pdbligand=YDK:2-(CARBAMOYLAMINO)-5-PHENYL-N-[(3S)-PIPERIDIN-3-YL]THIOPHENE-3-CARBOXAMIDE'>YDK</scene></td></tr> | ||
<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[2xf0|2xf0]], [[2brb|2brb]], [[2x8d|2x8d]], [[2wmr|2wmr]], [[2cgv|2cgv]], [[2brn|2brn]], [[2wmx|2wmx]], [[2ayp|2ayp]], [[2cgu|2cgu]], [[1nvs|1nvs]], [[2brm|2brm]], [[1nvq|1nvq]], [[2wmt|2wmt]], [[2ydi|2ydi]], [[2cgx|2cgx]], [[2c3j|2c3j]], [[2bro|2bro]], [[2wmw|2wmw]], [[2wmu|2wmu]], [[2brh|2brh]], [[2x8e|2x8e]], [[2c3k|2c3k]], [[1nvr|1nvr]], [[2wmq|2wmq]], [[1zlt|1zlt]], [[2cgw|2cgw]], [[2xez|2xez]], [[1zys|1zys]], [[1ia8|1ia8]], [[2br1|2br1]], [[2brg|2brg]], [[2wmv|2wmv]], [[2wms|2wms]], [[2c3l|2c3l]], [[2x8i|2x8i]], [[2xey|2xey]], [[2ydj|2ydj]]</td></tr> | <tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[2xf0|2xf0]], [[2brb|2brb]], [[2x8d|2x8d]], [[2wmr|2wmr]], [[2cgv|2cgv]], [[2brn|2brn]], [[2wmx|2wmx]], [[2ayp|2ayp]], [[2cgu|2cgu]], [[1nvs|1nvs]], [[2brm|2brm]], [[1nvq|1nvq]], [[2wmt|2wmt]], [[2ydi|2ydi]], [[2cgx|2cgx]], [[2c3j|2c3j]], [[2bro|2bro]], [[2wmw|2wmw]], [[2wmu|2wmu]], [[2brh|2brh]], [[2x8e|2x8e]], [[2c3k|2c3k]], [[1nvr|1nvr]], [[2wmq|2wmq]], [[1zlt|1zlt]], [[2cgw|2cgw]], [[2xez|2xez]], [[1zys|1zys]], [[1ia8|1ia8]], [[2br1|2br1]], [[2brg|2brg]], [[2wmv|2wmv]], [[2wms|2wms]], [[2c3l|2c3l]], [[2x8i|2x8i]], [[2xey|2xey]], [[2ydj|2ydj]]</td></tr> | ||
<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Non-specific_serine/threonine_protein_kinase Non-specific serine/threonine protein kinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.11.1 2.7.11.1] </span></td></tr> | <tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Non-specific_serine/threonine_protein_kinase Non-specific serine/threonine protein kinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.11.1 2.7.11.1] </span></td></tr> | ||
<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=2ydk FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2ydk OCA], [http://www.rcsb.org/pdb/explore.do?structureId=2ydk RCSB], [http://www.ebi.ac.uk/pdbsum/2ydk PDBsum]</span></td></tr> | <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=2ydk FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2ydk OCA], [http://pdbe.org/2ydk PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=2ydk RCSB], [http://www.ebi.ac.uk/pdbsum/2ydk PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=2ydk ProSAT]</span></td></tr> | ||
</table> | </table> | ||
== Function == | == Function == | ||
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From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br> | From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br> | ||
</div> | </div> | ||
<div class="pdbe-citations 2ydk" style="background-color:#fffaf0;"></div> | |||
==See Also== | ==See Also== | ||
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__TOC__ | __TOC__ | ||
</StructureSection> | </StructureSection> | ||
[[Category: | [[Category: Human]] | ||
[[Category: Non-specific serine/threonine protein kinase]] | [[Category: Non-specific serine/threonine protein kinase]] | ||
[[Category: Breed, J]] | [[Category: Breed, J]] | ||