2i40

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[[Image:2i40.gif|left|200px]]
[[Image:2i40.gif|left|200px]]
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{{Structure
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<!--
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|PDB= 2i40 |SIZE=350|CAPTION= <scene name='initialview01'>2i40</scene>, resolution 2.80&Aring;
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The line below this paragraph, containing "STRUCTURE_2i40", creates the "Structure Box" on the page.
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|SITE=
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You may change the PDB parameter (which sets the PDB file loaded into the applet)
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|LIGAND= <scene name='pdbligand=BLZ:5-[5,6-BIS(METHYLOXY)-1H-BENZIMIDAZOL-1-YL]-3-{[1-(2-CHLOROPHENYL)ETHYL]OXY}-2-THIOPHENECARBOXAMIDE'>BLZ</scene>
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or the SCENE parameter (which sets the initial scene displayed when the page is loaded),
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|ACTIVITY= <span class='plainlinks'>[http://en.wikipedia.org/wiki/Cyclin-dependent_kinase Cyclin-dependent kinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.11.22 2.7.11.22] </span>
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or leave the SCENE parameter empty for the default display.
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|GENE= CDK2 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 Homo sapiens]), CCNA2, CCN1, CCNA ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 Homo sapiens])
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-->
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|DOMAIN=
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{{STRUCTURE_2i40| PDB=2i40 | SCENE= }}
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|RELATEDENTRY=[[1fin|1FIN]]
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2i40 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2i40 OCA], [http://www.ebi.ac.uk/pdbsum/2i40 PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=2i40 RCSB]</span>
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}}
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'''Cdk2/Cyclin A complexed with a thiophene carboxamide inhibitor'''
'''Cdk2/Cyclin A complexed with a thiophene carboxamide inhibitor'''
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[[Category: Protein complex]]
[[Category: Protein complex]]
[[Category: Shewchuk, L M.]]
[[Category: Shewchuk, L M.]]
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[[Category: cdk2]]
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[[Category: Cdk2]]
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[[Category: cyclin]]
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[[Category: Cyclin]]
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[[Category: kinase]]
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[[Category: Kinase]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun May 4 07:02:25 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 03:39:24 2008''
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Revision as of 04:02, 4 May 2008

Image:2i40.gif

Template:STRUCTURE 2i40

Cdk2/Cyclin A complexed with a thiophene carboxamide inhibitor


Overview

The identification and hit-to-lead exploration of a novel, potent and selective series of substituted benzimidazole-thiophene carbonitrile inhibitors of IKK-epsilon kinase is described. Compound 12e was identified with an IKK-epsilon enzyme potency of pIC(50) 7.4, and has a highly encouraging wider selectivity profile, including selectivity within the IKK kinase family.

About this Structure

2I40 is a Protein complex structure of sequences from Homo sapiens. Full crystallographic information is available from OCA.

Reference

5-(1H-Benzimidazol-1-yl)-3-alkoxy-2-thiophenecarbonitriles as potent, selective, inhibitors of IKK-epsilon kinase., Bamborough P, Christopher JA, Cutler GJ, Dickson MC, Mellor GW, Morey JV, Patel CB, Shewchuk LM, Bioorg Med Chem Lett. 2006 Dec 15;16(24):6236-40. Epub 2006 Sep 25. PMID:16997559 Page seeded by OCA on Sun May 4 07:02:25 2008

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OCA

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