4e7w - Revision history

OCA at 09:57, 30 October 2024

2024-10-30T09:57:26Z

← Older revision		Revision as of 09:57, 30 October 2024
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	<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [https://pdbe.org/4e7w PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [https://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>		<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [https://pdbe.org/4e7w PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [https://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>
	</table>		</table>
			<div style="background-color:#fffaf0;">
			== Publication Abstract from PubMed ==
			Protein kinases are key enzymes in the complex regulation of cellular processes in almost all living organisms. For this reason, protein kinases represent attractive targets to stop the growth of eukaryotic pathogens such as protozoa and fungi. However, using kinase inhibitors to fight against these organisms bears several challenges since most of them are unselective and will also affect crucial host kinases. Here we present the X-ray structure of glycogen synthase kinase 3 from the fungal plant pathogen Ustilago maydis (<italic>Um</italic>GSK3) and its inhibition by type-II kinase inhibitors. Despite the high sequence homology between the human and the fungal variant of this vital kinase, we found substantial differences in the conformational plasticity of their active sites. Compounds that induced such conformational changes could be used to selectively inhibit the fungal kinase version. This study serves as an example how species specific selectivity of inhibitors can be achieved by identifying and addressing the inactive state of a protein kinase. In addition to this, our study gives interesting insights into the molecular plasticity of <italic>Um</italic>GSK3 by revealing a previously unknown inactive conformation of this important kinase family.

			Targeting GSK3 from <italic>Ustilago maydis</italic>: Type-II kinase inhibitors as potential antifungals.,Grutter C, Simard JR, Mayer-Wrangowski SC, Schreier PH, Perez-Martin J, Richters A, Getlik M, Gutbrod O, Braun CA, Beck ME, Rauh D ACS Chem Biol. 2012 Apr 30. PMID:22545924<ref>PMID:22545924</ref>

			From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>
			</div>
			<div class="pdbe-citations 4e7w" style="background-color:#fffaf0;"></div>

	==See Also==		==See Also==
	*[[Glycogen synthase kinase 3 3D structures\|Glycogen synthase kinase 3 3D structures]]		*[[Glycogen synthase kinase 3 3D structures\|Glycogen synthase kinase 3 3D structures]]
			== References ==
			<references/>
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>

OCA at 14:54, 14 March 2024

2024-03-14T14:54:59Z

← Older revision		Revision as of 14:54, 14 March 2024
Line 8:		Line 8:
	<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [https://pdbe.org/4e7w PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [https://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>		<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [https://pdbe.org/4e7w PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [https://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>
	</table>		</table>
	~~<div style="background-color:#fffaf0;">~~
	~~== Publication Abstract from PubMed ==~~
	Protein kinases are key enzymes in the complex regulation of cellular processes in almost all living organisms. For this reason, protein kinases represent attractive targets to stop the growth of eukaryotic pathogens such as protozoa and fungi. However, using kinase inhibitors to fight against these organisms bears several challenges since most of them are unselective and will also affect crucial host kinases. Here we present the X-ray structure of glycogen synthase kinase 3 from the fungal plant pathogen Ustilago maydis (<italic>Um</italic>GSK3) and its inhibition by type-II kinase inhibitors. Despite the high sequence homology between the human and the fungal variant of this vital kinase, we found substantial differences in the conformational plasticity of their active sites. Compounds that induced such conformational changes could be used to selectively inhibit the fungal kinase version. This study serves as an example how species specific selectivity of inhibitors can be achieved by identifying and addressing the inactive state of a protein kinase. In addition to this, our study gives interesting insights into the molecular plasticity of <italic>Um</italic>GSK3 by revealing a previously unknown inactive conformation of this important kinase family.

	Targeting GSK3 from <italic>Ustilago maydis</italic>: Type-II kinase inhibitors as potential antifungals.,Grutter C, Simard JR, Mayer-Wrangowski SC, Schreier PH, Perez-Martin J, Richters A, Getlik M, Gutbrod O, Braun CA, Beck ME, Rauh D ACS Chem Biol. 2012 Apr 30. PMID:22545924<ref>PMID:22545924</ref>

	~~From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>~~
	~~</div>~~
	~~<div class="pdbe-citations 4e7w" style="background-color:#fffaf0;"></div>~~

	==See Also==		==See Also==
	*[[Glycogen synthase kinase 3 3D structures\|Glycogen synthase kinase 3 3D structures]]		*[[Glycogen synthase kinase 3 3D structures\|Glycogen synthase kinase 3 3D structures]]
	~~== References ==~~
	~~<references/>~~
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>

OCA at 08:21, 6 December 2023

2023-12-06T08:21:21Z

← Older revision		Revision as of 08:21, 6 December 2023
Line 4:		Line 4:
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Ustilago_maydis_521 Ustilago maydis 521]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4E7W FirstGlance]. <br>		<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Ustilago_maydis_521 Ustilago maydis 521]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4E7W FirstGlance]. <br>
	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>		</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models\|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution\|Resolution]] 3.3Å</td></tr>
			<tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>
	<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [https://pdbe.org/4e7w PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [https://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>		<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [https://pdbe.org/4e7w PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [https://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>
	</table>		</table>

OCA at 06:56, 28 September 2022

2022-09-28T06:56:04Z

← Older revision		Revision as of 06:56, 28 September 2022
Line 1:		Line 1:

	==Structure of GSK3 from Ustilago maydis==		==Structure of GSK3 from Ustilago maydis==
	<StructureSection load='4e7w' size='340' side='right' caption='[[4e7w]], [[Resolution\|resolution]] 3.30Å' scene=''>		<StructureSection load='4e7w' size='340' side='right'caption='[[4e7w]], [[Resolution\|resolution]] 3.30Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [~~http~~://en.wikipedia.org/wiki/~~Corn_smut_fungus Corn smut fungus~~]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [~~http~~://~~oca~~.~~weizmann.ac.il/oca-docs~~/fgij/fg.htm?mol=4E7W FirstGlance]. <br>		<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Ustilago_maydis_521 Ustilago maydis 521]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4E7W FirstGlance]. <br>
	</td></tr><tr id='~~NonStdRes~~'><td class="sblockLbl"><b>[[~~Non-Standard_Residue~~\|~~NonStd Res~~:]]</b></td><td class="sblockDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene~~></td></tr>~~		</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>
	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">UM00560.1 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=237631 Corn smut fungus])</td></tr>		<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [https://pdbe.org/4e7w PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [https://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>
	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[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] </span></td></tr>
	<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[~~http~~://~~oca~~.~~weizmann.ac.il/oca-docs~~/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [~~http~~://pdbe.org/4e7w PDBe], [~~http~~://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [~~http~~://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [~~http~~://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>
	</table>		</table>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
Line 20:		Line 18:

	==See Also==		==See Also==
	*[[Glycogen synthase kinase 3\|Glycogen synthase kinase 3]]		*[[Glycogen synthase kinase 3 3D structures\|Glycogen synthase kinase 3 3D structures]]
	== References ==		== References ==
	<references/>		<references/>
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>
	[[Category: ~~Corn smut fungus~~]]		[[Category: Large Structures]]
	[[Category: ~~Non-specific serine/threonine protein kinase~~]]		[[Category: Ustilago maydis 521]]
	[[Category: Gruetter, C]]		[[Category: Gruetter C]]
	[[Category: Rauh, D]]		[[Category: Rauh D]]
	~~[[Category: Gsk3]]~~
	~~[[Category: Kinase]]~~
	~~[[Category: Ptyr195]]~~
	~~[[Category: Transferase~~]]

OCA at 10:47, 11 August 2016

2016-08-11T10:47:33Z

← Older revision		Revision as of 10:47, 11 August 2016
Line 1:		Line 1:

	==Structure of GSK3 from Ustilago maydis==		==Structure of GSK3 from Ustilago maydis==
	<StructureSection load='4e7w' size='340' side='right' caption='[[4e7w]], [[Resolution\|resolution]] 3.30Å' scene=''>		<StructureSection load='4e7w' size='340' side='right' caption='[[4e7w]], [[Resolution\|resolution]] 3.30Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/~~Ustilago_maydis Ustilago maydis~~]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4E7W FirstGlance]. <br>		<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Corn_smut_fungus Corn smut fungus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4E7W FirstGlance]. <br>
	</td></tr><tr id='NonStdRes'><td class="sblockLbl"><b>[[Non-Standard_Residue\|NonStd Res:]]</b></td><td class="sblockDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>		</td></tr><tr id='NonStdRes'><td class="sblockLbl"><b>[[Non-Standard_Residue\|NonStd Res:]]</b></td><td class="sblockDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>
	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">UM00560.1 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=~~5270 Ustilago maydis~~])</td></tr>		<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">UM00560.1 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=237631 Corn smut fungus])</td></tr>
	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[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] </span></td></tr>		<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[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] </span></td></tr>
	<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [http://www.ebi.ac.uk/pdbsum/4e7w PDBsum]</span></td></tr>		<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [http://pdbe.org/4e7w PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [http://www.ebi.ac.uk/pdbsum/4e7w PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=4e7w ProSAT]</span></td></tr>
	</table>		</table>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
Line 16:		Line 17:
	From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>		From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>
	</div>		</div>
			<div class="pdbe-citations 4e7w" style="background-color:#fffaf0;"></div>

	==See Also==		==See Also==
Line 23:		Line 25:
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>
			[[Category: Corn smut fungus]]
	[[Category: Non-specific serine/threonine protein kinase]]		[[Category: Non-specific serine/threonine protein kinase]]
	~~[[Category: Ustilago maydis]]~~
	[[Category: Gruetter, C]]		[[Category: Gruetter, C]]
	[[Category: Rauh, D]]		[[Category: Rauh, D]]

OCA at 12:23, 4 January 2015

2015-01-04T12:23:22Z

← Older revision		Revision as of 12:23, 4 January 2015
Line 3:		Line 3:
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Ustilago_maydis Ustilago maydis]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4E7W FirstGlance]. <br>		<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Ustilago_maydis Ustilago maydis]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4E7W FirstGlance]. <br>
	</td></tr><tr><td class="sblockLbl"><b>[[Non-Standard_Residue\|NonStd Res:]]</b></td><td class="sblockDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>		</td></tr><tr id='NonStdRes'><td class="sblockLbl"><b>[[Non-Standard_Residue\|NonStd Res:]]</b></td><td class="sblockDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>
	<tr><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">UM00560.1 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5270 Ustilago maydis])</td></tr>		<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">UM00560.1 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5270 Ustilago maydis])</td></tr>
	<tr><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[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] </span></td></tr>		<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[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] </span></td></tr>
	<tr><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [http://www.ebi.ac.uk/pdbsum/4e7w PDBsum]</span></td></tr>		<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [http://www.ebi.ac.uk/pdbsum/4e7w PDBsum]</span></td></tr>
	<table>		</table>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
	== Publication Abstract from PubMed ==		== Publication Abstract from PubMed ==
Line 14:		Line 14:
	Targeting GSK3 from <italic>Ustilago maydis</italic>: Type-II kinase inhibitors as potential antifungals.,Grutter C, Simard JR, Mayer-Wrangowski SC, Schreier PH, Perez-Martin J, Richters A, Getlik M, Gutbrod O, Braun CA, Beck ME, Rauh D ACS Chem Biol. 2012 Apr 30. PMID:22545924<ref>PMID:22545924</ref>		Targeting GSK3 from <italic>Ustilago maydis</italic>: Type-II kinase inhibitors as potential antifungals.,Grutter C, Simard JR, Mayer-Wrangowski SC, Schreier PH, Perez-Martin J, Richters A, Getlik M, Gutbrod O, Braun CA, Beck ME, Rauh D ACS Chem Biol. 2012 Apr 30. PMID:22545924<ref>PMID:22545924</ref>

	From ~~MEDLINEÂ®~~/~~PubMedÂ®~~, a database of the U.S. National Library of Medicine.<br>		From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>
	</div>		</div>

Line 25:		Line 25:
	[[Category: Non-specific serine/threonine protein kinase]]		[[Category: Non-specific serine/threonine protein kinase]]
	[[Category: Ustilago maydis]]		[[Category: Ustilago maydis]]
	[[Category: Gruetter, C.]]		[[Category: Gruetter, C]]
	[[Category: Rauh, D.]]		[[Category: Rauh, D]]
	[[Category: Gsk3]]		[[Category: Gsk3]]
	[[Category: Kinase]]		[[Category: Kinase]]
	[[Category: Ptyr195]]		[[Category: Ptyr195]]
	[[Category: Transferase]]		[[Category: Transferase]]

OCA at 07:20, 5 June 2014

2014-06-05T07:20:38Z

← Older revision		Revision as of 07:20, 5 June 2014
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	[[~~Image~~:~~4e7w~~.~~png~~\|~~left~~\|~~200px~~]]		==Structure of GSK3 from Ustilago maydis==
			<StructureSection load='4e7w' size='340' side='right' caption='[[4e7w]], [[Resolution\|resolution]] 3.30Å' scene=''>
			== Structural highlights ==
			<table><tr><td colspan='2'>[[4e7w]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Ustilago_maydis Ustilago maydis]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4E7W FirstGlance]. <br>
			</td></tr><tr><td class="sblockLbl"><b>[[Non-Standard_Residue\|NonStd Res:]]</b></td><td class="sblockDat"><scene name='pdbligand=PTR:O-PHOSPHOTYROSINE'>PTR</scene></td></tr>
			<tr><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">UM00560.1 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5270 Ustilago maydis])</td></tr>
			<tr><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[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] </span></td></tr>
			<tr><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4e7w FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4e7w OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4e7w RCSB], [http://www.ebi.ac.uk/pdbsum/4e7w PDBsum]</span></td></tr>
			<table>
			<div style="background-color:#fffaf0;">
			== Publication Abstract from PubMed ==
			Protein kinases are key enzymes in the complex regulation of cellular processes in almost all living organisms. For this reason, protein kinases represent attractive targets to stop the growth of eukaryotic pathogens such as protozoa and fungi. However, using kinase inhibitors to fight against these organisms bears several challenges since most of them are unselective and will also affect crucial host kinases. Here we present the X-ray structure of glycogen synthase kinase 3 from the fungal plant pathogen Ustilago maydis (<italic>Um</italic>GSK3) and its inhibition by type-II kinase inhibitors. Despite the high sequence homology between the human and the fungal variant of this vital kinase, we found substantial differences in the conformational plasticity of their active sites. Compounds that induced such conformational changes could be used to selectively inhibit the fungal kinase version. This study serves as an example how species specific selectivity of inhibitors can be achieved by identifying and addressing the inactive state of a protein kinase. In addition to this, our study gives interesting insights into the molecular plasticity of <italic>Um</italic>GSK3 by revealing a previously unknown inactive conformation of this important kinase family.

	~~{{STRUCTURE_4e7w\| PDB=4e7w \| SCENE= }}~~		Targeting GSK3 from <italic>Ustilago maydis</italic>: Type-II kinase inhibitors as potential antifungals.,Grutter C, Simard JR, Mayer-Wrangowski SC, Schreier PH, Perez-Martin J, Richters A, Getlik M, Gutbrod O, Braun CA, Beck ME, Rauh D ACS Chem Biol. 2012 Apr 30. PMID:22545924<ref>PMID:22545924</ref>

	~~===Structure~~ of ~~GSK3 from Ustilago maydis===~~		From MEDLINEÂ®/PubMedÂ®, a database of the U.S. National Library of Medicine.<br>
			</div>

	~~{{ABSTRACT_PUBMED_22545924}}~~		==See Also==
			*[[Glycogen synthase kinase 3\|Glycogen synthase kinase 3]]
	==~~About this Structure~~==		== References ==
	[[~~4e7w]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Ustilago_maydis Ustilago maydis~~]~~. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4E7W OCA~~].		<references/>
			__TOC__
	==~~Reference~~==		</StructureSection>
	<~~ref group="xtra">PMID:022545924<~~/~~ref~~><~~references group="xtra"~~/>
	[[Category: Non-specific serine/threonine protein kinase]]		[[Category: Non-specific serine/threonine protein kinase]]
	[[Category: Ustilago maydis]]		[[Category: Ustilago maydis]]

OCA at 05:02, 1 August 2012

2012-08-01T05:02:07Z

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	[[Image:4e7w.~~jpg~~\|left\|200px]]		[[Image:4e7w.png\|left\|200px]]

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	===Structure of GSK3 from Ustilago maydis===		===Structure of GSK3 from Ustilago maydis===


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OCA at 09:12, 16 May 2012

2012-05-16T09:12:49Z

@@ Line 1: / Line 1: @@
-'''Unreleased structure'''
+[[Image:4e7w.jpg|left|200px]]
-The entry 4e7w is ON HOLD  until Paper Publication
+<!--
-Authors: Gruetter, C., Rauh, D.
+===Structure of GSK3 from Ustilago maydis===
-Description: Structure of GSK3 from Ustilago maydis

OCA at 08:51, 25 April 2012

2012-04-25T08:51:10Z

← Older revision		Revision as of 08:51, 25 April 2012
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	'''Unreleased structure'''		'''Unreleased structure'''

	The entry 4e7w is ON HOLD		The entry 4e7w is ON HOLD until Paper Publication

	Authors: Gruetter, C., Rauh, D.		Authors: Gruetter, C., Rauh, D.

	Description: Structure of GSK3 from Ustilago maydis		Description: Structure of GSK3 from Ustilago maydis