2uw0

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|PDB= 2uw0 |SIZE=350|CAPTION= <scene name='initialview01'>2uw0</scene>, resolution 2.00&Aring;
|PDB= 2uw0 |SIZE=350|CAPTION= <scene name='initialview01'>2uw0</scene>, resolution 2.00&Aring;
|SITE= <scene name='pdbsite=AC1:Gvk+Binding+Site+For+Chain+A'>AC1</scene>
|SITE= <scene name='pdbsite=AC1:Gvk+Binding+Site+For+Chain+A'>AC1</scene>
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|LIGAND= <scene name='pdbligand=GVK:6-{4-[4-(4-CHLOROPHENYL)PIPERIDIN-4-YL]PHENYL}-9H-PURINE'>GVK</scene>
+
|LIGAND= <scene name='pdbligand=GVK:6-{4-[4-(4-CHLOROPHENYL)PIPERIDIN-4-YL]PHENYL}-9H-PURINE'>GVK</scene>, <scene name='pdbligand=SEP:PHOSPHOSERINE'>SEP</scene>, <scene name='pdbligand=TPO:PHOSPHOTHREONINE'>TPO</scene>
|ACTIVITY=
|ACTIVITY=
|GENE=
|GENE=
 +
|DOMAIN=
 +
|RELATEDENTRY=[[1cmk|1CMK]], [[1xh4|1XH4]], [[1xh5|1XH5]], [[1xh6|1XH6]], [[1xh7|1XH7]], [[1xh8|1XH8]], [[1xh9|1XH9]], [[1xha|1XHA]], [[1ydr|1YDR]], [[2c1a|2C1A]], [[2c1b|2C1B]], [[2f7e|2F7E]], [[2gni|2GNI]], [[2jds|2JDS]], [[2jdt|2JDT]], [[2jdv|2JDV]], [[1kmu|1KMU]], [[1kmw|1KMW]], [[1q24|1Q24]], [[1q61|1Q61]], [[1q62|1Q62]], [[1q8t|1Q8T]], [[1q8u|1Q8U]], [[1q8w|1Q8W]], [[1smh|1SMH]], [[1stc|1STC]], [[1sve|1SVE]], [[1svg|1SVG]], [[1svh|1SVH]], [[1szm|1SZM]], [[1veb|1VEB]], [[1yds|1YDS]], [[1ydt|1YDT]], [[2gfc|2GFC]], [[2gnf|2GNF]], [[2gng|2GNG]], [[2gnh|2GNH]], [[2gnj|2GNJ]], [[2gnl|2GNL]], [[2uvx|2UVX]], [[2uvy|2UVY]], [[2uvz|2UVZ]]
 +
|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2uw0 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2uw0 OCA], [http://www.ebi.ac.uk/pdbsum/2uw0 PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=2uw0 RCSB]</span>
}}
}}
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[[Category: Mchardy, T.]]
[[Category: Mchardy, T.]]
[[Category: Rowlands, M G.]]
[[Category: Rowlands, M G.]]
-
[[Category: GVK]]
 
[[Category: atp-binding]]
[[Category: atp-binding]]
[[Category: camp]]
[[Category: camp]]
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[[Category: transferase/inhibitor complex]]
[[Category: transferase/inhibitor complex]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Mar 20 18:40:24 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 05:05:14 2008''

Revision as of 02:05, 31 March 2008

Image:2uw0.gif


PDB ID 2uw0

Drag the structure with the mouse to rotate
, resolution 2.00Å
Sites:
Ligands: , ,
Related: 1CMK, 1XH4, 1XH5, 1XH6, 1XH7, 1XH8, 1XH9, 1XHA, 1YDR, 2C1A, 2C1B, 2F7E, 2GNI, 2JDS, 2JDT, 2JDV, 1KMU, 1KMW, 1Q24, 1Q61, 1Q62, 1Q8T, 1Q8U, 1Q8W, 1SMH, 1STC, 1SVE, 1SVG, 1SVH, 1SZM, 1VEB, 1YDS, 1YDT, 2GFC, 2GNF, 2GNG, 2GNH, 2GNJ, 2GNL, 2UVX, 2UVY, 2UVZ


Resources: FirstGlance, OCA, PDBsum, RCSB
Coordinates: save as pdb, mmCIF, xml



STRUCTURE OF PKA-PKB CHIMERA COMPLEXED WITH 6-(4-(4-(4-CHLORO-PHENYL)-PIPERIDIN-4-YL)-PHENYL)-9H-PURINE


Overview

6-phenylpurines were identified as novel, ATP-competitive inhibitors of protein kinase B (PKB/Akt) from a fragment-based screen and were rapidly progressed to potent compounds using iterative protein-ligand crystallography with a PKA-PKB chimeric protein. An elaborated lead compound showed cell growth inhibition and effects on cellular signaling pathways characteristic of PKB inhibition.

About this Structure

2UW0 is a Protein complex structure of sequences from Bos taurus. Full crystallographic information is available from OCA.

Reference

Rapid evolution of 6-phenylpurine inhibitors of protein kinase B through structure-based design., Donald A, McHardy T, Rowlands MG, Hunter LJ, Davies TG, Berdini V, Boyle RG, Aherne GW, Garrett MD, Collins I, J Med Chem. 2007 May 17;50(10):2289-92. Epub 2007 Apr 24. PMID:17451235

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