2ghm
From Proteopedia
(New page: 200px<br /><applet load="2ghm" size="450" color="white" frame="true" align="right" spinBox="true" caption="2ghm, resolution 2.35Å" /> '''Mutated MAP kinase P...) |
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| - | [[Image:2ghm.gif|left|200px]]<br /><applet load="2ghm" size=" | + | [[Image:2ghm.gif|left|200px]]<br /><applet load="2ghm" size="350" color="white" frame="true" align="right" spinBox="true" |
caption="2ghm, resolution 2.35Å" /> | caption="2ghm, resolution 2.35Å" /> | ||
'''Mutated MAP kinase P38 (Mus Musculus) in complex with Inhbitor PG-895449'''<br /> | '''Mutated MAP kinase P38 (Mus Musculus) in complex with Inhbitor PG-895449'''<br /> | ||
==Overview== | ==Overview== | ||
| - | A new class of tumor necrosis factor alpha (TNF-alpha) synthesis | + | A new class of tumor necrosis factor alpha (TNF-alpha) synthesis inhibitors based on an N-2,4-pyrimidine-N-phenyl-N'-phenyl urea scaffold is described. Many of these compounds showed low-nanomolar activity against lipopolysaccharide stimulated TNF-alpha production. X-ray co-crystallization studies with mutated p38alpha showed that these trisubstituted ureas interact with the ATP-binding pocket in a pseudo-bicyclic conformation brought about by the presence of an intramolecular hydrogen bonding interaction. |
==About this Structure== | ==About this Structure== | ||
| - | 2GHM is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Mus_musculus Mus musculus] with LIC 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:// | + | 2GHM is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Mus_musculus Mus musculus] with <scene name='pdbligand=LIC:'>LIC</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=2GHM 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: Evdokimov, A | + | [[Category: Evdokimov, A G.]] |
| - | [[Category: Maier, J | + | [[Category: Maier, J A.]] |
| - | [[Category: Mekel, M | + | [[Category: Mekel, M J.]] |
| - | [[Category: Pokross, M | + | [[Category: Pokross, M E.]] |
| - | [[Category: Walter, R | + | [[Category: Walter, R L.]] |
[[Category: LIC]] | [[Category: LIC]] | ||
[[Category: map kinase p38]] | [[Category: map kinase p38]] | ||
| - | ''Page seeded by [http:// | + | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 17:31:46 2008'' |
Revision as of 15:31, 21 February 2008
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Mutated MAP kinase P38 (Mus Musculus) in complex with Inhbitor PG-895449
Overview
A new class of tumor necrosis factor alpha (TNF-alpha) synthesis inhibitors based on an N-2,4-pyrimidine-N-phenyl-N'-phenyl urea scaffold is described. Many of these compounds showed low-nanomolar activity against lipopolysaccharide stimulated TNF-alpha production. X-ray co-crystallization studies with mutated p38alpha showed that these trisubstituted ureas interact with the ATP-binding pocket in a pseudo-bicyclic conformation brought about by the presence of an intramolecular hydrogen bonding interaction.
About this Structure
2GHM is a Single protein structure of sequence from Mus musculus with as ligand. Active as Non-specific serine/threonine protein kinase, with EC number 2.7.11.1 Full crystallographic information is available from OCA.
Reference
Development of N-2,4-pyrimidine-N-phenyl-N'-phenyl ureas as inhibitors of tumor necrosis factor alpha (TNF-alpha) synthesis. Part 1., Brugel TA, Maier JA, Clark MP, Sabat M, Golebiowski A, Bookland RG, Laufersweiler MJ, Laughlin SK, Vanrens JC, De B, Hsieh LC, Mekel MJ, Janusz MJ, Bioorg Med Chem Lett. 2006 Jul 1;16(13):3510-3. Epub 2006 May 2. PMID:16632356
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