3nhf - Revision history

OCA at 10:00, 14 February 2024

2024-02-14T10:00:26Z

←Older revision		Revision as of 10:00, 14 February 2024
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	<StructureSection load='3nhf' size='340' side='right'caption='[[3nhf]], [[Resolution\|resolution]] 2.00Å' scene=''>		<StructureSection load='3nhf' size='340' side='right'caption='[[3nhf]], [[Resolution\|resolution]] 2.00Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
-	<table><tr><td colspan='2'>[[3nhf]] is a 2 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=3NHF OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3NHF FirstGlance]. <br>	+	<table><tr><td colspan='2'>[[3nhf]] is a 2 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=3NHF OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3NHF FirstGlance]. <br>
-	</td></tr><tr id='~~ligand~~'><td class="sblockLbl"><b>[[~~Ligand~~\|~~Ligands~~:]]</b></td><td class="sblockDat" id="~~ligandDat~~">~~<scene name='pdbligand=FAD:FLAVIN~~-~~ADENINE+DINUCLEOTIDE'>FAD</scene>~~, ~~<scene name='pdbligand=VVV:5,6,8-TRIMETHOXY-4-METHYLQUINOLIN-~~2~~(1H)-ONE'>VVV</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</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;~~'>~~[[3nhj\|3nhj]], [[3nhk\|3nhk]], [[3nhl\|3nhl]], [[3nhp\|3nhp]], [[3nhr\|3nhr]], [[3nhs\|3nhs]], [[3nhu\|3nhu]], [[3nhw\|3nhw]], [[3nhy\|3nhy]], [[3gam\|3gam]], [[3g5m\|3g5m]]~~</~~div~~><~~/td></tr>~~	+	<tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=VVV:5,6,8-TRIMETHOXY-4-METHYLQUINOLIN-2(1H)-ONE'>VVV</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
-	~~<tr id~~='~~gene'><td class~~=~~"sblockLbl"><b>[[Gene\|Gene~~:~~]]</b></td><td class="sblockDat">NQO2~~, ~~NMOR2~~ (~~[https://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 HUMAN]~~)~~</td~~></tr>	+
-	<~~tr id~~='~~activity'><td class~~=~~"sblockLbl"><b>Activity~~:~~</b></td><td class="sblockDat"><span class='plainlinks~~'>[https://en.wikipedia.org/wiki/Ribosyldihydronicotinamide_dehydrogenase_(quinone) Ribosyldihydronicotinamide dehydrogenase (quinone)], with EC number [https://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.10.99.2 1.10.99.2] </~~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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [https://pdbe.org/3nhf PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [https://www.ebi.ac.uk/pdbsum/3nhf PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3nhf 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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [https://pdbe.org/3nhf PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [https://www.ebi.ac.uk/pdbsum/3nhf PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3nhf ProSAT]</span></td></tr>
	</table>		</table>
	== Function ==		== Function ==
-	[[https://www.uniprot.org/uniprot/NQO2_HUMAN NQO2_HUMAN]] The enzyme apparently serves as a quinone reductase in connection with conjugation reactions of hydroquinones involved in detoxification pathways as well as in biosynthetic processes such as the vitamin K-dependent gamma-carboxylation of glutamate residues in prothrombin synthesis.<ref>PMID:18254726</ref>	+	[https://www.uniprot.org/uniprot/NQO2_HUMAN NQO2_HUMAN] The enzyme apparently serves as a quinone reductase in connection with conjugation reactions of hydroquinones involved in detoxification pathways as well as in biosynthetic processes such as the vitamin K-dependent gamma-carboxylation of glutamate residues in prothrombin synthesis.<ref>PMID:18254726</ref>
-	~~<div style="background-color:#fffaf0;">~~	+
-	~~== Publication Abstract from PubMed ==~~	+
-	An efficient method has been developed to synthesize casimiroin (1), a component of the edible fruit of Casimiroa edulis, on a multigram scale in good overall yield. The route was versatile enough to provide an array of compound 1 analogues that were evaluated as QR2 and aromatase inhibitors. In addition, X-ray crystallography studies of QR2 in complex with compound 1 and one of its more potent analogues has provided insight into the mechanism of action of this new series of QR2 inhibitors. The initial biological investigations suggest that compound 1 and its analogues merit further investigation as potential chemopreventive or chemotherapeutic agents.	+
-		+
-	Synthesis of Casimiroin and Optimization of Its Quinone Reductase 2 and Aromatase Inhibitory Activities.,Maiti A, Reddy PV, Sturdy M, Marler L, Pegan SD, Mesecar AD, Pezzuto JM, Cushman M J Med Chem. 2009 Mar 6. PMID:19265439<ref>PMID:19265439</ref>	+
-		+
-	~~From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>~~	+
-	~~</div>~~	+
-	~~<div class="pdbe-citations 3nhf" style="background-color:#fffaf0;"></div~~>	+

	==See Also==		==See Also==
-	*[[Quinone reductase\|Quinone reductase]]	+	*[[Quinone reductase 3D structures\|Quinone reductase 3D structures]]
	== References ==		== References ==
	<references/>		<references/>
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>
-	[[Category: ~~Human~~]]	+	[[Category: Homo sapiens]]
	[[Category: Large Structures]]		[[Category: Large Structures]]
-	[[Category: Sturdy, M]]	+	[[Category: Sturdy M]]
-	~~[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]~~	+
-	~~[[Category: Protein dimer~~]]	+

OCA at 07:02, 12 May 2022

2022-05-12T07:02:09Z

←Older revision		Revision as of 07:02, 12 May 2022
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	==X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2==		==X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2==
-	<StructureSection load='3nhf' size='340' side='right' caption='[[3nhf]], [[Resolution\|resolution]] 2.00Å' scene=''>	+	<StructureSection load='3nhf' size='340' side='right'caption='[[3nhf]], [[Resolution\|resolution]] 2.00Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
-	<table><tr><td colspan='2'>[[3nhf]] is a 2 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=3NHF OCA]. For a <b>guided tour on the structure components</b> use [~~http~~://~~oca~~.~~weizmann.ac.il/oca-docs~~/fgij/fg.htm?mol=3NHF FirstGlance]. <br>	+	<table><tr><td colspan='2'>[[3nhf]] is a 2 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=3NHF OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3NHF FirstGlance]. <br>
-	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=VVV:5,6,8-TRIMETHOXY-4-METHYLQUINOLIN-2(1H)-ONE'>VVV</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>	+	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=VVV:5,6,8-TRIMETHOXY-4-METHYLQUINOLIN-2(1H)-ONE'>VVV</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
-	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3nhj\|3nhj]], [[3nhk\|3nhk]], [[3nhl\|3nhl]], [[3nhp\|3nhp]], [[3nhr\|3nhr]], [[3nhs\|3nhs]], [[3nhu\|3nhu]], [[3nhw\|3nhw]], [[3nhy\|3nhy]], [[3gam\|3gam]], [[3g5m\|3g5m]]</td></tr>	+	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat"><div style='overflow: auto; max-height: 3em;'>[[3nhj\|3nhj]], [[3nhk\|3nhk]], [[3nhl\|3nhl]], [[3nhp\|3nhp]], [[3nhr\|3nhr]], [[3nhs\|3nhs]], [[3nhu\|3nhu]], [[3nhw\|3nhw]], [[3nhy\|3nhy]], [[3gam\|3gam]], [[3g5m\|3g5m]]</div></td></tr>
-	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">NQO2, NMOR2 ([~~http~~://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 HUMAN])</td></tr>	+	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">NQO2, NMOR2 ([https://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 HUMAN])</td></tr>
-	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[~~http~~://en.wikipedia.org/wiki/Ribosyldihydronicotinamide_dehydrogenase_(quinone) Ribosyldihydronicotinamide dehydrogenase (quinone)], with EC number [~~http~~://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.10.99.2 1.10.99.2] </span></td></tr>	+	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[https://en.wikipedia.org/wiki/Ribosyldihydronicotinamide_dehydrogenase_(quinone) Ribosyldihydronicotinamide dehydrogenase (quinone)], with EC number [https://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.10.99.2 1.10.99.2] </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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [~~http~~://pdbe.org/3nhf PDBe], [~~http~~://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [~~http~~://www.ebi.ac.uk/pdbsum/3nhf PDBsum], [~~http~~://prosat.h-its.org/prosat/prosatexe?pdbcode=3nhf 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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [https://pdbe.org/3nhf PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [https://www.ebi.ac.uk/pdbsum/3nhf PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3nhf ProSAT]</span></td></tr>
	</table>		</table>
	== Function ==		== Function ==
-	[[~~http~~://www.uniprot.org/uniprot/NQO2_HUMAN NQO2_HUMAN]] The enzyme apparently serves as a quinone reductase in connection with conjugation reactions of hydroquinones involved in detoxification pathways as well as in biosynthetic processes such as the vitamin K-dependent gamma-carboxylation of glutamate residues in prothrombin synthesis.<ref>PMID:18254726</ref>	+	[[https://www.uniprot.org/uniprot/NQO2_HUMAN NQO2_HUMAN]] The enzyme apparently serves as a quinone reductase in connection with conjugation reactions of hydroquinones involved in detoxification pathways as well as in biosynthetic processes such as the vitamin K-dependent gamma-carboxylation of glutamate residues in prothrombin synthesis.<ref>PMID:18254726</ref>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
	== Publication Abstract from PubMed ==		== Publication Abstract from PubMed ==
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	</div>		</div>
	<div class="pdbe-citations 3nhf" style="background-color:#fffaf0;"></div>		<div class="pdbe-citations 3nhf" style="background-color:#fffaf0;"></div>
		+
		+	==See Also==
		+	*[[Quinone reductase\|Quinone reductase]]
	== References ==		== References ==
	<references/>		<references/>
Line 26:		Line 29:
	</StructureSection>		</StructureSection>
	[[Category: Human]]		[[Category: Human]]
		+	[[Category: Large Structures]]
	[[Category: Sturdy, M]]		[[Category: Sturdy, M]]
	[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]		[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]
	[[Category: Protein dimer]]		[[Category: Protein dimer]]

OCA at 08:29, 8 November 2017

2017-11-08T08:29:31Z

←Older revision		Revision as of 08:29, 8 November 2017
Line 21:		Line 21:
	</div>		</div>
	<div class="pdbe-citations 3nhf" style="background-color:#fffaf0;"></div>		<div class="pdbe-citations 3nhf" style="background-color:#fffaf0;"></div>
-
-	==See Also==
-	*[[Quinone reductase\|Quinone reductase]]
	== References ==		== References ==
	<references/>		<references/>

OCA at 08:17, 5 August 2016

2016-08-05T08:17:02Z

←Older revision		Revision as of 08:17, 5 August 2016
Line 1:		Line 1:
		+
	==X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2==		==X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2==
	<StructureSection load='3nhf' size='340' side='right' caption='[[3nhf]], [[Resolution\|resolution]] 2.00Å' scene=''>		<StructureSection load='3nhf' size='340' side='right' caption='[[3nhf]], [[Resolution\|resolution]] 2.00Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
-	<table><tr><td colspan='2'>[[3nhf]] is a 2 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=3NHF OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3NHF FirstGlance]. <br>	+	<table><tr><td colspan='2'>[[3nhf]] is a 2 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=3NHF OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3NHF FirstGlance]. <br>
	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=VVV:5,6,8-TRIMETHOXY-4-METHYLQUINOLIN-2(1H)-ONE'>VVV</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>		</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=VVV:5,6,8-TRIMETHOXY-4-METHYLQUINOLIN-2(1H)-ONE'>VVV</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3nhj\|3nhj]], [[3nhk\|3nhk]], [[3nhl\|3nhl]], [[3nhp\|3nhp]], [[3nhr\|3nhr]], [[3nhs\|3nhs]], [[3nhu\|3nhu]], [[3nhw\|3nhw]], [[3nhy\|3nhy]], [[3gam\|3gam]], [[3g5m\|3g5m]]</td></tr>		<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3nhj\|3nhj]], [[3nhk\|3nhk]], [[3nhl\|3nhl]], [[3nhp\|3nhp]], [[3nhr\|3nhr]], [[3nhs\|3nhs]], [[3nhu\|3nhu]], [[3nhw\|3nhw]], [[3nhy\|3nhy]], [[3gam\|3gam]], [[3g5m\|3g5m]]</td></tr>
-	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">NQO2, NMOR2 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 ~~Homo sapiens~~])</td></tr>	+	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">NQO2, NMOR2 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 HUMAN])</td></tr>
	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Ribosyldihydronicotinamide_dehydrogenase_(quinone) Ribosyldihydronicotinamide dehydrogenase (quinone)], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.10.99.2 1.10.99.2] </span></td></tr>		<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Ribosyldihydronicotinamide_dehydrogenase_(quinone) Ribosyldihydronicotinamide dehydrogenase (quinone)], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.10.99.2 1.10.99.2] </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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [http://www.ebi.ac.uk/pdbsum/3nhf 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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [http://pdbe.org/3nhf PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [http://www.ebi.ac.uk/pdbsum/3nhf PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=3nhf ProSAT]</span></td></tr>
	</table>		</table>
	== Function ==		== Function ==
Line 19:		Line 20:
	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 3nhf" style="background-color:#fffaf0;"></div>

	==See Also==		==See Also==
Line 26:		Line 28:
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>
-	[[Category: ~~Homo sapiens~~]]	+	[[Category: Human]]
	[[Category: Sturdy, M]]		[[Category: Sturdy, M]]
	[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]		[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]
	[[Category: Protein dimer]]		[[Category: Protein dimer]]

OCA at 17:12, 25 December 2014

2014-12-25T17:12:02Z

←Older revision		Revision as of 17:12, 25 December 2014
Line 9:		Line 9:
	<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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [http://www.ebi.ac.uk/pdbsum/3nhf 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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [http://www.ebi.ac.uk/pdbsum/3nhf PDBsum]</span></td></tr>
	</table>		</table>
		+	== Function ==
		+	[[http://www.uniprot.org/uniprot/NQO2_HUMAN NQO2_HUMAN]] The enzyme apparently serves as a quinone reductase in connection with conjugation reactions of hydroquinones involved in detoxification pathways as well as in biosynthetic processes such as the vitamin K-dependent gamma-carboxylation of glutamate residues in prothrombin synthesis.<ref>PMID:18254726</ref>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
	== Publication Abstract from PubMed ==		== Publication Abstract from PubMed ==

OCA at 11:09, 9 December 2014

2014-12-09T11:09:21Z

←Older revision		Revision as of 11:09, 9 December 2014
Line 1:		Line 1:
-	[[~~Image:~~3nhf.~~png~~\|~~left~~\|~~200px~~]]	+	==X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2==
		+	<StructureSection load='3nhf' size='340' side='right' caption='[[3nhf]], [[Resolution\|resolution]] 2.00Å' scene=''>
		+	== Structural highlights ==
		+	<table><tr><td colspan='2'>[[3nhf]] is a 2 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=3NHF OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3NHF FirstGlance]. <br>
		+	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>, <scene name='pdbligand=VVV:5,6,8-TRIMETHOXY-4-METHYLQUINOLIN-2(1H)-ONE'>VVV</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
		+	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3nhj\|3nhj]], [[3nhk\|3nhk]], [[3nhl\|3nhl]], [[3nhp\|3nhp]], [[3nhr\|3nhr]], [[3nhs\|3nhs]], [[3nhu\|3nhu]], [[3nhw\|3nhw]], [[3nhy\|3nhy]], [[3gam\|3gam]], [[3g5m\|3g5m]]</td></tr>
		+	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">NQO2, NMOR2 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 Homo sapiens])</td></tr>
		+	<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Ribosyldihydronicotinamide_dehydrogenase_(quinone) Ribosyldihydronicotinamide dehydrogenase (quinone)], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.10.99.2 1.10.99.2] </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=3nhf FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3nhf OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3nhf RCSB], [http://www.ebi.ac.uk/pdbsum/3nhf PDBsum]</span></td></tr>
		+	</table>
		+	<div style="background-color:#fffaf0;">
		+	== Publication Abstract from PubMed ==
		+	An efficient method has been developed to synthesize casimiroin (1), a component of the edible fruit of Casimiroa edulis, on a multigram scale in good overall yield. The route was versatile enough to provide an array of compound 1 analogues that were evaluated as QR2 and aromatase inhibitors. In addition, X-ray crystallography studies of QR2 in complex with compound 1 and one of its more potent analogues has provided insight into the mechanism of action of this new series of QR2 inhibitors. The initial biological investigations suggest that compound 1 and its analogues merit further investigation as potential chemopreventive or chemotherapeutic agents.

-	~~{{STRUCTURE_3nhf\| PDB=3nhf \| SCENE= }}~~	+	Synthesis of Casimiroin and Optimization of Its Quinone Reductase 2 and Aromatase Inhibitory Activities.,Maiti A, Reddy PV, Sturdy M, Marler L, Pegan SD, Mesecar AD, Pezzuto JM, Cushman M J Med Chem. 2009 Mar 6. PMID:19265439<ref>PMID:19265439</ref>

-	~~===X-ray Crystallographic Structure Activity Relationship (SAR)~~ of ~~Casimiroin and its Analogs Bound to Human Quinone Reductase 2===~~	+	From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>
-		+	</div>
-	~~{{ABSTRACT_PUBMED_19265439}}~~	+
-		+
-	~~==About this Structure==~~	+
-	~~[[3nhf]] is a 2 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=3NHF OCA].~~	+

	==See Also==		==See Also==
	*[[Quinone reductase\|Quinone reductase]]		*[[Quinone reductase\|Quinone reductase]]
-		+	== References ==
-	==~~Reference~~==	+	<references/>
-	<~~ref group="xtra">PMID:019265439<~~/~~ref~~><~~references group="xtra"~~/>	+	__TOC__
		+	</StructureSection>
	[[Category: Homo sapiens]]		[[Category: Homo sapiens]]
-	[[Category: Sturdy, M.]]	+	[[Category: Sturdy, M]]
	[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]		[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]
	[[Category: Protein dimer]]		[[Category: Protein dimer]]

OCA at 19:18, 20 October 2012

2012-10-20T19:18:53Z

←Older revision		Revision as of 19:18, 20 October 2012
Line 8:		Line 8:

	==About this Structure==		==About this Structure==
-	[[3nhf]] is a 2 chain structure ~~of [[Quinone reductase]]~~ 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=3NHF OCA].	+	[[3nhf]] is a 2 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=3NHF OCA].

	==See Also==		==See Also==

OCA at 06:56, 27 July 2012

2012-07-27T06:56:40Z

←Older revision		Revision as of 06:56, 27 July 2012
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	[[Image:3nhf.png\|left\|200px]]		[[Image:3nhf.png\|left\|200px]]

-	<!--
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-	-->
	{{STRUCTURE_3nhf\| PDB=3nhf \| SCENE= }}		{{STRUCTURE_3nhf\| PDB=3nhf \| SCENE= }}

	===X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2===		===X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2===

-
-	<!--
-	The line below this paragraph, {{ABSTRACT_PUBMED_19265439}}, adds the Publication Abstract to the page
-	(as it appears on PubMed at http://www.pubmed.gov), where 19265439 is the PubMed ID number.
-	-->
	{{ABSTRACT_PUBMED_19265439}}		{{ABSTRACT_PUBMED_19265439}}

	==About this Structure==		==About this Structure==
-	[[3nhf]] is a 2 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=3NHF OCA].	+	[[3nhf]] is a 2 chain structure of [[Quinone reductase]] 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=3NHF OCA].
		+
		+	==See Also==
		+	*[[Quinone reductase\|Quinone reductase]]

	==Reference==		==Reference==

OCA at 06:22, 11 January 2012

2012-01-11T06:22:58Z

←Older revision		Revision as of 06:22, 11 January 2012
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-	~~'''Unreleased structure'''~~	+	[[Image:3nhf.png\|left\|200px]]

-	The ~~entry 3nhf~~ is ~~ON HOLD~~ ~~until Jan 11 2013~~	+	<!--
		+	The line below this paragraph, containing "STRUCTURE_3nhf", 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_3nhf\| PDB=3nhf \| SCENE= }}

-	~~Authors: Sturdy, M.~~	+	===X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2===

-	~~Description: X~~-~~ray Crystallographic Structure Activity Relationship~~ (~~SAR~~) ~~of Casimiroin and its Analogs Bound to Human Quinone Reductase~~ 2	+
		+	<!--
		+	The line below this paragraph, {{ABSTRACT_PUBMED_19265439}}, adds the Publication Abstract to the page
		+	(as it appears on PubMed at http://www.pubmed.gov), where 19265439 is the PubMed ID number.
		+	-->
		+	{{ABSTRACT_PUBMED_19265439}}
		+
		+	==About this Structure==
		+	[[3nhf]] is a 2 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=3NHF OCA].
		+
		+	==Reference==
		+	<ref group="xtra">PMID:019265439</ref><references group="xtra"/>
		+	[[Category: Homo sapiens]]
		+	[[Category: Sturdy, M.]]
		+	[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]
		+	[[Category: Protein dimer]]

OCA at 06:31, 28 December 2011

2011-12-28T06:31:55Z

←Older revision		Revision as of 06:31, 28 December 2011
Line 1:		Line 1:
	'''Unreleased structure'''		'''Unreleased structure'''

-	The entry 3nhf is ON HOLD until ~~Dec 20 2012~~	+	The entry 3nhf is ON HOLD until Jan 11 2013

	Authors: Sturdy, M.		Authors: Sturdy, M.

	Description: X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2		Description: X-ray Crystallographic Structure Activity Relationship (SAR) of Casimiroin and its Analogs Bound to Human Quinone Reductase 2