2xp3 - Revision history

OCA at 10:36, 20 December 2023

2023-12-20T10:36:13Z

← Older revision		Revision as of 10:36, 20 December 2023
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	<StructureSection load='2xp3' size='340' side='right'caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>		<StructureSection load='2xp3' size='340' side='right'caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/~~Human Human~~]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>		<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>
	</td></tr><tr id='~~ligand~~'><td class="sblockLbl"><b>[[~~Ligand~~\|~~Ligands~~:]]</b></td><td class="sblockDat" id="~~ligandDat~~">~~<scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>~~, ~~<scene name='pdbligand=B21:5-(~~2~~-METHOXYPHENYL)-2-FUROIC+ACID'>B21</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]] 2Å</td></tr>
	<tr id='~~related~~'><td class="sblockLbl"><b>[[~~Related_structure~~\|~~Related~~:]]</b></td><td class="sblockDat"><~~div style~~='~~overflow~~: ~~auto; max-height: 3em;~~'>[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</~~div~~><~~/td></tr>~~		<tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>
	~~<tr id~~='~~activity'><td class~~=~~"sblockLbl"><b>Activity~~:~~</b></td><td class="sblockDat"><span class='plainlinks'>[https://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [https://www.brenda~~-~~enzymes.info/php/result_flat.php4?ecno=5.~~2~~.1.8 5.~~2~~.1.8]~~ </~~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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [https://pdbe.org/2xp3 PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [https://www.ebi.ac.uk/pdbsum/2xp3 PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=2xp3 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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [https://pdbe.org/2xp3 PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [https://www.ebi.ac.uk/pdbsum/2xp3 PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=2xp3 ProSAT]</span></td></tr>
	</table>		</table>
	== Function ==		== Function ==
	[[https://www.uniprot.org/uniprot/PIN1_HUMAN PIN1_HUMAN]] Essential PPIase that regulates mitosis presumably by interacting with NIMA and attenuating its mitosis-promoting activity. Displays a preference for an acidic residue N-terminal to the isomerized proline bond. Catalyzes pSer/Thr-Pro cis/trans isomerizations. Down-regulates kinase activity of BTK. Can transactivate multiple oncogenes and induce centrosome amplification, chromosome instability and cell transformation. Required for the efficient dephosphorylation and recycling of RAF1 after mitogen activation.<ref>PMID:15664191</ref> <ref>PMID:16644721</ref> <ref>PMID:21497122</ref>		[https://www.uniprot.org/uniprot/PIN1_HUMAN PIN1_HUMAN] Essential PPIase that regulates mitosis presumably by interacting with NIMA and attenuating its mitosis-promoting activity. Displays a preference for an acidic residue N-terminal to the isomerized proline bond. Catalyzes pSer/Thr-Pro cis/trans isomerizations. Down-regulates kinase activity of BTK. Can transactivate multiple oncogenes and induce centrosome amplification, chromosome instability and cell transformation. Required for the efficient dephosphorylation and recycling of RAF1 after mitogen activation.<ref>PMID:15664191</ref> <ref>PMID:16644721</ref> <ref>PMID:21497122</ref>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
	== Publication Abstract from PubMed ==		== Publication Abstract from PubMed ==
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	__TOC__		__TOC__
	</StructureSection>		</StructureSection>
	[[Category: ~~Human~~]]		[[Category: Homo sapiens]]
	[[Category: Large Structures]]		[[Category: Large Structures]]
	~~[[Category: Peptidylprolyl isomerase]]~~		[[Category: Baker L]]
	[[Category: Baker, L]]		[[Category: Bryant CJ]]
	[[Category: Bryant~~, C J~~]]		[[Category: Davis BE]]
	[[Category: Davis~~, B E~~]]		[[Category: Dokurno P]]
	[[Category: Dokurno, P]]		[[Category: Fromont C]]
	[[Category: Fromont, C]]		[[Category: Matossova N]]
	[[Category: Matossova, N]]		[[Category: Moore JD]]
	[[Category: Moore~~, J D~~]]		[[Category: Murray JB]]
	[[Category: Murray~~, J B~~]]		[[Category: Northfield CJ]]
	[[Category: Northfield~~, C J~~]]		[[Category: Nunns C]]
	[[Category: Nunns, C]]		[[Category: Oldfield V]]
	[[Category: Oldfield, V]]		[[Category: Potter A]]
	[[Category: Potter, A]]		[[Category: Ray S]]
	[[Category: Ray, S]]		[[Category: Richardson CM]]
	[[Category: Richardson~~, C M~~]]		[[Category: Robinson D]]
	[[Category: Robinson, D]]		[[Category: Scrace SF]]
	[[Category: Scrace~~, S F~~]]		[[Category: Surgenor AE]]
	[[Category: Surgenor~~, A E]]~~
	~~[[Category: Cell cycle]]~~
	~~[[Category: Isomerase]]~~
	~~[[Category: Oncogenic transformation]]~~
	~~[[Category: Proline directed kinase~~]]

OCA at 05:24, 10 August 2022

2022-08-10T05:24:38Z

← Older revision		Revision as of 05:24, 10 August 2022
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	<StructureSection load='2xp3' size='340' side='right'caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>		<StructureSection load='2xp3' size='340' side='right'caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [~~http~~://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [~~http~~://proteopedia.org/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>		<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>
	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>		</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>
	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</td></tr>		<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat"><div style='overflow: auto; max-height: 3em;'>[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</div></td></tr>
	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[~~http~~://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [~~http~~://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </span></td></tr>		<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[https://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [https://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </span></td></tr>
	<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[~~http~~://proteopedia.org/fgij/fg.htm?mol=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [~~http~~://pdbe.org/2xp3 PDBe], [~~http~~://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [~~http~~://www.ebi.ac.uk/pdbsum/2xp3 PDBsum], [~~http~~://prosat.h-its.org/prosat/prosatexe?pdbcode=2xp3 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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [https://pdbe.org/2xp3 PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [https://www.ebi.ac.uk/pdbsum/2xp3 PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=2xp3 ProSAT]</span></td></tr>
	</table>		</table>
	== Function ==		== Function ==
	[[~~http~~://www.uniprot.org/uniprot/PIN1_HUMAN PIN1_HUMAN]] Essential PPIase that regulates mitosis presumably by interacting with NIMA and attenuating its mitosis-promoting activity. Displays a preference for an acidic residue N-terminal to the isomerized proline bond. Catalyzes pSer/Thr-Pro cis/trans isomerizations. Down-regulates kinase activity of BTK. Can transactivate multiple oncogenes and induce centrosome amplification, chromosome instability and cell transformation. Required for the efficient dephosphorylation and recycling of RAF1 after mitogen activation.<ref>PMID:15664191</ref> <ref>PMID:16644721</ref> <ref>PMID:21497122</ref>		[[https://www.uniprot.org/uniprot/PIN1_HUMAN PIN1_HUMAN]] Essential PPIase that regulates mitosis presumably by interacting with NIMA and attenuating its mitosis-promoting activity. Displays a preference for an acidic residue N-terminal to the isomerized proline bond. Catalyzes pSer/Thr-Pro cis/trans isomerizations. Down-regulates kinase activity of BTK. Can transactivate multiple oncogenes and induce centrosome amplification, chromosome instability and cell transformation. Required for the efficient dephosphorylation and recycling of RAF1 after mitogen activation.<ref>PMID:15664191</ref> <ref>PMID:16644721</ref> <ref>PMID:21497122</ref>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
	== Publication Abstract from PubMed ==		== Publication Abstract from PubMed ==

OCA at 08:01, 4 November 2020

2020-11-04T08:01:56Z

← Older revision		Revision as of 08:01, 4 November 2020
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	==DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION==		==DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION==
	<StructureSection load='2xp3' size='340' side='right' caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>		<StructureSection load='2xp3' size='340' side='right'caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [http://~~oca~~.~~weizmann.ac.il/oca-docs~~/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>		<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [http://proteopedia.org/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>
	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>		</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>
	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</td></tr>		<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</td></tr>
	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </span></td></tr>		<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [http://pdbe.org/2xp3 PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [http://www.ebi.ac.uk/pdbsum/2xp3 PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=2xp3 ProSAT]</span></td></tr>		<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://proteopedia.org/fgij/fg.htm?mol=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [http://pdbe.org/2xp3 PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [http://www.ebi.ac.uk/pdbsum/2xp3 PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=2xp3 ProSAT]</span></td></tr>
	</table>		</table>
	== Function ==		== Function ==
Line 22:		Line 22:

	==See Also==		==See Also==
	*[[Peptidyl-prolyl cis-trans isomerase\|Peptidyl-prolyl cis-trans isomerase]]		*[[Peptidyl-prolyl cis-trans isomerase 3D structures\|Peptidyl-prolyl cis-trans isomerase 3D structures]]
	== References ==		== References ==
	<references/>		<references/>
Line 28:		Line 28:
	</StructureSection>		</StructureSection>
	[[Category: Human]]		[[Category: Human]]
			[[Category: Large Structures]]
	[[Category: Peptidylprolyl isomerase]]		[[Category: Peptidylprolyl isomerase]]
	[[Category: Baker, L]]		[[Category: Baker, L]]

OCA at 17:09, 5 August 2016

2016-08-05T17:09:16Z

← Older revision		Revision as of 17:09, 5 August 2016
Line 1:		Line 1:

	==DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION==		==DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION==
	<StructureSection load='2xp3' size='340' side='right' caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>		<StructureSection load='2xp3' size='340' side='right' caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
	<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/~~Homo_sapiens Homo sapiens~~]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>		<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>
	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>		</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>
	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</td></tr>		<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</td></tr>
	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </span></td></tr>		<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [http://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [http://www.ebi.ac.uk/pdbsum/2xp3 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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [http://pdbe.org/2xp3 PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [http://www.ebi.ac.uk/pdbsum/2xp3 PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=2xp3 ProSAT]</span></td></tr>
	</table>		</table>
	== Function ==		== Function ==
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	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 2xp3" style="background-color:#fffaf0;"></div>

			==See Also==
			*[[Peptidyl-prolyl cis-trans isomerase\|Peptidyl-prolyl cis-trans isomerase]]
	== References ==		== References ==
	<references/>		<references/>
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>
	[[Category: ~~Homo sapiens~~]]		[[Category: Human]]
	[[Category: Peptidylprolyl isomerase]]		[[Category: Peptidylprolyl isomerase]]
	[[Category: Baker, L]]		[[Category: Baker, L]]

OCA at 04:18, 25 December 2014

2014-12-25T04:18:14Z

← Older revision		Revision as of 04:18, 25 December 2014
Line 8:		Line 8:
	<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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [http://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [http://www.ebi.ac.uk/pdbsum/2xp3 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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [http://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [http://www.ebi.ac.uk/pdbsum/2xp3 PDBsum]</span></td></tr>
	</table>		</table>
			== Function ==
			[[http://www.uniprot.org/uniprot/PIN1_HUMAN PIN1_HUMAN]] Essential PPIase that regulates mitosis presumably by interacting with NIMA and attenuating its mitosis-promoting activity. Displays a preference for an acidic residue N-terminal to the isomerized proline bond. Catalyzes pSer/Thr-Pro cis/trans isomerizations. Down-regulates kinase activity of BTK. Can transactivate multiple oncogenes and induce centrosome amplification, chromosome instability and cell transformation. Required for the efficient dephosphorylation and recycling of RAF1 after mitogen activation.<ref>PMID:15664191</ref> <ref>PMID:16644721</ref> <ref>PMID:21497122</ref>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
	== Publication Abstract from PubMed ==		== Publication Abstract from PubMed ==
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	[[Category: Homo sapiens]]		[[Category: Homo sapiens]]
	[[Category: Peptidylprolyl isomerase]]		[[Category: Peptidylprolyl isomerase]]
	[[Category: Baker, L.]]		[[Category: Baker, L]]
	[[Category: Bryant, C J.]]		[[Category: Bryant, C J]]
	[[Category: Davis, B E.]]		[[Category: Davis, B E]]
	[[Category: Dokurno, P.]]		[[Category: Dokurno, P]]
	[[Category: Fromont, C.]]		[[Category: Fromont, C]]
	[[Category: Matossova, N.]]		[[Category: Matossova, N]]
	[[Category: Moore, J D.]]		[[Category: Moore, J D]]
	[[Category: Murray, J B.]]		[[Category: Murray, J B]]
	[[Category: Northfield, C J.]]		[[Category: Northfield, C J]]
	[[Category: Nunns, C.]]		[[Category: Nunns, C]]
	[[Category: Oldfield, V.]]		[[Category: Oldfield, V]]
	[[Category: Potter, A.]]		[[Category: Potter, A]]
	[[Category: Ray, S.]]		[[Category: Ray, S]]
	[[Category: Richardson, C M.]]		[[Category: Richardson, C M]]
	[[Category: Robinson, D.]]		[[Category: Robinson, D]]
	[[Category: Scrace, S F.]]		[[Category: Scrace, S F]]
	[[Category: Surgenor, A E.]]		[[Category: Surgenor, A E]]
	[[Category: Cell cycle]]		[[Category: Cell cycle]]
	[[Category: Isomerase]]		[[Category: Isomerase]]
	[[Category: Oncogenic transformation]]		[[Category: Oncogenic transformation]]
	[[Category: Proline directed kinase]]		[[Category: Proline directed kinase]]

OCA at 13:07, 22 October 2014

2014-10-22T13:07:59Z

← Older revision		Revision as of 13:07, 22 October 2014
Line 1:		Line 1:
	[[~~Image~~:~~2xp3~~.~~png~~\|~~left~~\|~~200px~~]]		==DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION==
			<StructureSection load='2xp3' size='340' side='right' caption='[[2xp3]], [[Resolution\|resolution]] 2.00Å' scene=''>
			== Structural highlights ==
			<table><tr><td colspan='2'>[[2xp3]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2XP3 FirstGlance]. <br>
			</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=12P:DODECAETHYLENE+GLYCOL'>12P</scene>, <scene name='pdbligand=B21:5-(2-METHOXYPHENYL)-2-FUROIC+ACID'>B21</scene></td></tr>
			<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[1f8a\|1f8a]], [[1i8g\|1i8g]], [[1pin\|1pin]], [[2xpb\|2xpb]], [[2xp5\|2xp5]], [[1nmw\|1nmw]], [[2xp4\|2xp4]], [[1zcn\|1zcn]], [[2f21\|2f21]], [[2xp6\|2xp6]], [[2xp8\|2xp8]], [[1nmv\|1nmv]], [[2xp9\|2xp9]], [[2xp7\|2xp7]], [[1i8h\|1i8h]], [[2xpa\|2xpa]], [[1i6c\|1i6c]]</td></tr>
			<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </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=2xp3 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xp3 OCA], [http://www.rcsb.org/pdb/explore.do?structureId=2xp3 RCSB], [http://www.ebi.ac.uk/pdbsum/2xp3 PDBsum]</span></td></tr>
			</table>
			<div style="background-color:#fffaf0;">
			== Publication Abstract from PubMed ==
			Pin1 is an emerging oncology target strongly implicated in Ras and ErbB2-mediated tumourigenesis. Pin1 isomerizes bonds linking phospho-serine/threonine moieties to proline enabling it to play a key role in proline-directed kinase signalling. Here we report a novel series of Pin1 inhibitors based on a phenyl imidazole acid core that contains sub-muM inhibitors. Compounds have been identified that block prostate cancer cell growth under conditions where Pin1 is essential.

	~~{{STRUCTURE_2xp3\| PDB=2xp3 \| SCENE= }}~~		Discovery of cell-active phenyl-imidazole Pin1 inhibitors by structure-guided fragment evolution.,Potter A, Oldfield V, Nunns C, Fromont C, Ray S, Northfield CJ, Bryant CJ, Scrace SF, Robinson D, Matossova N, Baker L, Dokurno P, Surgenor AE, Davis B, Richardson CM, Murray JB, Moore JD Bioorg Med Chem Lett. 2010 Nov 15;20(22):6483-8. Epub 2010 Sep 17. PMID:20932746<ref>PMID:20932746</ref>

	~~===DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION===~~		From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>
			</div>
	~~{{ABSTRACT_PUBMED_20932746}}~~		== References ==
			<references/>
	~~==About this Structure==~~		__TOC__
	~~[[2xp3]] is~~ a ~~1 chain structure with sequence from [http://en~~.~~wikipedia~~.~~org/wiki/Homo_sapiens Homo sapiens]~~. ~~Full crystallographic information is available from [http:~~/~~/oca.weizmann.ac.il/oca-bin/ocashort?id=2XP3 OCA].~~		</StructureSection>

	==~~Reference~~==
	<~~ref group="xtra">PMID:020932746<~~/~~ref~~><~~references group="xtra"~~/>
	[[Category: Homo sapiens]]		[[Category: Homo sapiens]]
	[[Category: Peptidylprolyl isomerase]]		[[Category: Peptidylprolyl isomerase]]

OCA at 20:00, 7 January 2013

2013-01-07T20:00:39Z

← Older revision		Revision as of 20:00, 7 January 2013
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	[[Image:2xp3.~~jpg~~\|left\|200px]]		[[Image:2xp3.png\|left\|200px]]

	~~<!--~~
	~~The line below this paragraph, containing "STRUCTURE_2xp3", creates the "Structure Box" on the page.~~
	~~You may change the PDB parameter (which sets the PDB file loaded into the applet)~~
	~~or the SCENE parameter (which sets the initial scene displayed when the page is loaded),~~
	~~or leave the SCENE parameter empty for the default display.~~
	~~-->~~
	{{STRUCTURE_2xp3\| PDB=2xp3 \| SCENE= }}		{{STRUCTURE_2xp3\| PDB=2xp3 \| SCENE= }}

	===DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION===		===DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION===


	~~<!--~~
	~~The line below this paragraph, {{ABSTRACT_PUBMED_20932746}}, adds the Publication Abstract to the page~~
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	==Reference==		==Reference==
	<ref group="xtra">PMID:~~20932746~~</ref><references group="xtra"/>		<ref group="xtra">PMID:020932746</ref><references group="xtra"/>
	[[Category: Homo sapiens]]		[[Category: Homo sapiens]]
	[[Category: Peptidylprolyl isomerase]]		[[Category: Peptidylprolyl isomerase]]
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	[[Category: Scrace, S F.]]		[[Category: Scrace, S F.]]
	[[Category: Surgenor, A E.]]		[[Category: Surgenor, A E.]]
			[[Category: Cell cycle]]
			[[Category: Isomerase]]
			[[Category: Oncogenic transformation]]
			[[Category: Proline directed kinase]]

OCA: Protected "2xp3" [edit=sysop:move=sysop]

2011-01-12T05:09:30Z

Protected "2xp3" [edit=sysop:move=sysop]

← Older revision	Revision as of 05:09, 12 January 2011
(No difference)

OCA at 05:09, 12 January 2011

2011-01-12T05:09:28Z

@@ Line 1: / Line 1: @@
-'''Unreleased structure'''
+[[Image:2xp3.jpg|left|200px]]
-The entry 2xp3 is ON HOLD  until Paper Publication
+<!--
-Authors: POTTER, A., OLDFIELD, V., NUNNS, C., FROMONT, C., RAY, S., NORTHFIELD, C.J., BRYANT, C.J., SCRACE, S.F., ROBINSON, D., MATOSSOVA, N., BAKER, L., DOKURNO, P., SURGENOR, A.E., DAVIS, B.E., RICHARDSON, C.M., MURRAY, J.B., MOORE, J.D.
+===DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION===
-''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Wed Sep 15 10:28:21 2010''
+<!--

OCA at 07:19, 15 September 2010

2010-09-15T07:19:39Z

← Older revision		Revision as of 07:19, 15 September 2010
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	'''Unreleased structure'''		'''Unreleased structure'''

	The entry 2xp3 is ON HOLD		The entry 2xp3 is ON HOLD until Paper Publication

	Authors: POTTER, A., OLDFIELD, V., NUNNS, C., FROMONT, C., RAY, S., NORTHFIELD, C.J., BRYANT, C.J., SCRACE, S.F., ROBINSON, D., MATOSSOVA, N., BAKER, L., DOKURNO, P., SURGENOR, A.E., DAVIS, B.E., RICHARDSON, C.M., MURRAY, J.B., MOORE, J.D.		Authors: POTTER, A., OLDFIELD, V., NUNNS, C., FROMONT, C., RAY, S., NORTHFIELD, C.J., BRYANT, C.J., SCRACE, S.F., ROBINSON, D., MATOSSOVA, N., BAKER, L., DOKURNO, P., SURGENOR, A.E., DAVIS, B.E., RICHARDSON, C.M., MURRAY, J.B., MOORE, J.D.
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	Description: DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION		Description: DISCOVERY OF CELL-ACTIVE PHENYL-IMIDAZOLE PIN1 INHIBITORS BY STRUCTURE-GUIDED FRAGMENT EVOLUTION

	''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Wed Sep ~~1 09~~:29:13 2010''		''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Wed Sep 15 10:28:21 2010''