2pg2

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[[Image:2pg2.jpg|left|200px]]
[[Image:2pg2.jpg|left|200px]]
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{{Structure
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<!--
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|PDB= 2pg2 |SIZE=350|CAPTION= <scene name='initialview01'>2pg2</scene>, resolution 1.849&Aring;
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The line below this paragraph, containing "STRUCTURE_2pg2", 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=ADP:ADENOSINE-5&#39;-DIPHOSPHATE'>ADP</scene>, <scene name='pdbligand=K01:N,N-DIETHYL-2-[(2-THIENYLCARBONYL)AMINO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE'>K01</scene>, <scene name='pdbligand=MG:MAGNESIUM+ION'>MG</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=
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or leave the SCENE parameter empty for the default display.
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|GENE= KIF11, EG5, KNSL1, TRIP5 ([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_2pg2| PDB=2pg2 | SCENE= }}
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|RELATEDENTRY=
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2pg2 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2pg2 OCA], [http://www.ebi.ac.uk/pdbsum/2pg2 PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=2pg2 RCSB]</span>
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}}
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'''Crystal structure of KSP in complex with ADP and thiophene containing inhibitor 15'''
'''Crystal structure of KSP in complex with ADP and thiophene containing inhibitor 15'''
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[[Category: Single protein]]
[[Category: Single protein]]
[[Category: Lee, T T.]]
[[Category: Lee, T T.]]
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[[Category: complex]]
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[[Category: Complex]]
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[[Category: eg5]]
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[[Category: Eg5]]
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[[Category: inhibitor]]
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[[Category: Inhibitor]]
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[[Category: kinesin spindle protein]]
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[[Category: Kinesin spindle protein]]
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[[Category: ksp]]
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[[Category: Ksp]]
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[[Category: thiophene]]
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[[Category: Thiophene]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun May 4 13:02:29 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 04:35:32 2008''
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Revision as of 10:02, 4 May 2008

Image:2pg2.jpg

Template:STRUCTURE 2pg2

Crystal structure of KSP in complex with ADP and thiophene containing inhibitor 15


Overview

We have identified and synthesized a series of thiophene containing inhibitors of kinesin spindle protein. SAR studies led to the synthesis of 33, which was co-crystallized with KSP and determined to bind to an allosteric pocket previously described for other known KSP inhibitors.

About this Structure

2PG2 is a Single protein structure of sequence from Homo sapiens. Full crystallographic information is available from OCA.

Reference

Synthesis and SAR of thiophene containing kinesin spindle protein (KSP) inhibitors., Pinkerton AB, Lee TT, Hoffman TZ, Wang Y, Kahraman M, Cook TG, Severance D, Gahman TC, Noble SA, Shiau AK, Davis RL, Bioorg Med Chem Lett. 2007 Jul 1;17(13):3562-9. Epub 2007 Apr 29. PMID:17498954 Page seeded by OCA on Sun May 4 13:02:29 2008

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OCA

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