2uw6: Difference between revisions

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[[Image:2uw6.~~jpg~~|left|200px]]

[[Image:2uw6.png|left|200px]]

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~~'''~~STRUCTURE OF PKA-PKB CHIMERA COMPLEXED WITH (S)-2-(4-CHLORO-PHENYL)-2-(4-1H-PYRAZOL-4-YL)-PHENYL)-ETHYLAMINE~~'''~~

===STRUCTURE OF PKA-PKB CHIMERA COMPLEXED WITH (S)-2-(4-CHLORO-PHENYL)-2-(4-1H-PYRAZOL-4-YL)-PHENYL)-ETHYLAMINE===

~~==Overview==~~

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~~Using fragment-based screening techniques~~, ~~5-methyl-4-phenyl-1H-pyrazole~~ (~~IC50 80 microM~~) ~~was identified as a novel~~, ~~low molecular weight inhibitor of protein kinase B (PKB). Herein we describe~~ the ~~rapid elaboration of highly potent and ligand efficient analogues using a fragment growing approach~~. ~~Iterative structure~~-~~based design was supported by protein~~-~~ligand structure determinations using a PKA-PKB "chimera" and a final protein-ligand structure of a lead compound in PKBbeta itself.~~

The line below this paragraph, {{ABSTRACT_PUBMED_17451234}}, adds the Publication Abstract to the page

(as it appears on PubMed at http://www.pubmed.gov), where 17451234 is the PubMed ID number.

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==About this Structure==

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[[Category: Transferase]]

[[Category: Transferase/inhibitor complex]]

''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on ~~Wed Apr 30~~ 13:32:38 2008''

''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Fri Jul 11 13:11:57 2008''

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-[[Image:2uw6.jpg|left|200px]]
+{{Seed}}
+[[Image:2uw6.png|left|200px]]
 <!--
@@ Line 9: / Line 10: @@
 {{STRUCTURE_2uw6|  PDB=2uw6  |  SCENE=  }}
-'''STRUCTURE OF PKA-PKB CHIMERA COMPLEXED WITH (S)-2-(4-CHLORO-PHENYL)-2-(4-1H-PYRAZOL-4-YL)-PHENYL)-ETHYLAMINE'''
+===STRUCTURE OF PKA-PKB CHIMERA COMPLEXED WITH (S)-2-(4-CHLORO-PHENYL)-2-(4-1H-PYRAZOL-4-YL)-PHENYL)-ETHYLAMINE===
-==Overview==
+<!--
-Using fragment-based screening techniques, 5-methyl-4-phenyl-1H-pyrazole (IC50 80 microM) was identified as a novel, low molecular weight inhibitor of protein kinase B (PKB). Herein we describe the rapid elaboration of highly potent and ligand efficient analogues using a fragment growing approach. Iterative structure-based design was supported by protein-ligand structure determinations using a PKA-PKB "chimera" and a final protein-ligand structure of a lead compound in PKBbeta itself.
+The line below this paragraph, {{ABSTRACT_PUBMED_17451234}}, adds the Publication Abstract to the page
+(as it appears on PubMed at http://www.pubmed.gov), where 17451234 is the PubMed ID number.
+-->
+{{ABSTRACT_PUBMED_17451234}}
 ==About this Structure==
@@ Line 45: / Line 49: @@
 [[Category: Transferase]]
 [[Category: Transferase/inhibitor complex]]
-''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Wed Apr 30 13:32:38 2008''
+''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Fri Jul 11 13:11:57 2008''