1ykr: Difference between revisions
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New page: left|200px<br /> <applet load="1ykr" size="450" color="white" frame="true" align="right" spinBox="true" caption="1ykr, resolution 1.8Å" /> '''Crystal structure of... |
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[[Image:1ykr.gif|left|200px]]<br /> | [[Image:1ykr.gif|left|200px]]<br /><applet load="1ykr" size="350" color="white" frame="true" align="right" spinBox="true" | ||
<applet load="1ykr" size=" | |||
caption="1ykr, resolution 1.8Å" /> | caption="1ykr, resolution 1.8Å" /> | ||
'''Crystal structure of cdk2 with an aminoimidazo pyridine inhibitor'''<br /> | '''Crystal structure of cdk2 with an aminoimidazo pyridine inhibitor'''<br /> | ||
==Overview== | ==Overview== | ||
Structure-based design approach was successfully used to guide the | Structure-based design approach was successfully used to guide the evolution of imidazopyridine scaffold yielding new structural class of highly selective inhibitors of cyclin dependent kinases that were able to form a new interaction with an identified residue of the protein, Lys89. Compounds from this series have shown no detectable effect when tested against a representative set of other serine/threonine kinases such as GSK3beta, CAMKII, PKA, PKC-alpha,beta,epsilon,gamma. Compound 2i inhibits proliferation in HCT 116 cells in tissue culture. Synthesis, co-crystal structure of CDK2 in complex with compound 2i, and preliminary SAR study are disclosed. | ||
==About this Structure== | ==About this Structure== | ||
1YKR is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens] with 628 as [http://en.wikipedia.org/wiki/ligand ligand]. Active as [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] Full crystallographic information is available from [http:// | 1YKR is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens] with <scene name='pdbligand=628:'>628</scene> as [http://en.wikipedia.org/wiki/ligand ligand]. Active as [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] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1YKR OCA]. | ||
==Reference== | ==Reference== | ||
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[[Category: Non-specific serine/threonine protein kinase]] | [[Category: Non-specific serine/threonine protein kinase]] | ||
[[Category: Single protein]] | [[Category: Single protein]] | ||
[[Category: Brooks, H | [[Category: Brooks, H B.]] | ||
[[Category: Hamdouchi, C.]] | [[Category: Hamdouchi, C.]] | ||
[[Category: Jaramillo, C.]] | [[Category: Jaramillo, C.]] | ||
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[[Category: cell cycle division protein kinase 2]] | [[Category: cell cycle division protein kinase 2]] | ||
''Page seeded by [http:// | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 16:06:19 2008'' | ||
