3qly - Revision history

OCA at 11:50, 14 March 2024

2024-03-14T11:50:23Z

←Older revision		Revision as of 11:50, 14 March 2024
Line 3:		Line 3:
	<StructureSection load='3qly' size='340' side='right'caption='[[3qly]], [[Resolution\|resolution]] 2.52Å' scene=''>		<StructureSection load='3qly' size='340' side='right'caption='[[3qly]], [[Resolution\|resolution]] 2.52Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
-	<table><tr><td colspan='2'>[[3qly]] is a 2 chain structure with sequence from [https://en.wikipedia.org/wiki/~~Atcc_2001 Atcc 2001~~]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3QLY FirstGlance]. <br>	+	<table><tr><td colspan='2'>[[3qly]] is a 2 chain structure with sequence from [https://en.wikipedia.org/wiki/Candida_glabrata Candida glabrata]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3QLY FirstGlance]. <br>
-	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=55V:6-METHYL-5-[3-METHYL-3-(3,4,5-TRIMETHOXYPHENYL)BUT-1-YN-1-YL]PYRIMIDINE-2,4-DIAMINE'>55V</scene>, <scene name='pdbligand=NDP:NADPH+DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NDP</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]] 2.519Å</td></tr>
-	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat"><div style='overflow: auto; max-height: 3em;'>[[3eej\|3eej]], [[3eek\|3eek]], [[3eel\|3eel]], [[3eem\|3eem]], [[3cse\|3cse]]</div></td></tr>	+	<tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=55V:6-METHYL-5-[3-METHYL-3-(3,4,5-TRIMETHOXYPHENYL)BUT-1-YN-1-YL]PYRIMIDINE-2,4-DIAMINE'>55V</scene>, <scene name='pdbligand=NDP:NADPH+DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NDP</scene></td></tr>
-	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">CAGL0J03894g, DHFR ([https://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5478 ATCC 2001])</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=3qly FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3qly OCA], [https://pdbe.org/3qly PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3qly RCSB], [https://www.ebi.ac.uk/pdbsum/3qly PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3qly 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=3qly FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3qly OCA], [https://pdbe.org/3qly PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3qly RCSB], [https://www.ebi.ac.uk/pdbsum/3qly PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3qly ProSAT]</span></td></tr>
	</table>		</table>
-	~~<div style~~=~~"background-color:#fffaf0;">~~	+	== Function ==
-	=~~= Publication Abstract from PubMed~~ ==	+	[https://www.uniprot.org/uniprot/Q6FPH0_CANGA Q6FPH0_CANGA]
-	Candida albicans and Candida glabrata cause fungal bloodstream infections that are associated with significant mortality. As part of an effort to develop potent and selective antifolates that target dihydrofolate reductase (DHFR) from Candida species, we report three ternary crystal structures of Candida albicans DHFR (CaDHFR) bound to novel propargyl-linked analogs. Consistent with earlier modeling results, these structures show that hydrophobic pockets in the binding site may be exploited to increase ligand potency. The crystal structures also confirm that loop residues Thr 58- Phe 66, which flank the active site and influence ligand potency and selectivity, adopt multiple conformations. To aid the development of a dual Candida spp. inhibitor, three new crystal structures of C. glabrata DHFR (CgDHFR) bound to similar ligands as those bound in the ternary structures of CaDHFR are also reported here. Loop residues 58-66 in CgDHFR and human DHFR are 1 A and 3 A closer to the folate binding site, respectively, than loop residues in CaDHFR, suggesting that a properly size ligand could be a potent and selective dual inhibitor of CaDHFR and CgDHFR.	+
-		+
-	Crystal structures of Candida albicans dihydrofolate reductase bound to propargyl-linked antifolates reveal the flexibility of active site loop residues critical for ligand potency and selectivity.,Paulsen JL, Bendel SD, Anderson AC Chem Biol Drug Des. 2011 Jul 5. doi: ~~10.1111~~/~~j.1747-0285.2011.01169.x. PMID:21726415<ref>PMID:21726415<~~/~~ref>~~	+
-		+
-	~~From MEDLINE®/PubMed®, a database of the U~~.S. ~~National Library of Medicine.<br>~~	+
-	</~~div>~~	+
-	~~<div class="pdbe-citations 3qly" style="background-color:#fffaf0;"></div>~~	+
-	~~== References ==~~	+
-	~~<references~~/>	+
	__TOC__		__TOC__
	</StructureSection>		</StructureSection>
-	[[Category: Atcc 2001]]
	[[Category: Large Structures]]		[[Category: Large Structures]]
-	[[Category: Anderson~~, A C~~]]	+	[[Category: Anderson AC]]
-	[[Category: Bendel~~, S D~~]]	+	[[Category: Bendel SD]]
-	[[Category: Paulsen~~, J L]]~~	+	[[Category: Paulsen JL]]
-	~~[[Category: Antifungal agent]]~~	+
-	~~[[Category: Candida glabrata]]~~	+
-	~~[[Category: Drug design]]~~	+
-	~~[[Category: Enzyme inhibitor]]~~	+
-	~~[[Category: Fungal protein]]~~	+
-	~~[[Category: Model]]~~	+
-	~~[[Category: Molecular structure]]~~	+
-	~~[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]~~	+
-	~~[[Category: Structure-activity relationship]]~~	+
-	~~[[Category: Tetrahydrofolate dehydrogenase~~]]	+

OCA at 06:14, 8 June 2022

2022-06-08T06:14:15Z

←Older revision		Revision as of 06:14, 8 June 2022
Line 1:		Line 1:

	==Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)==		==Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)==
-	<StructureSection load='3qly' size='340' side='right' caption='[[3qly]], [[Resolution\|resolution]] 2.52Å' scene=''>	+	<StructureSection load='3qly' size='340' side='right'caption='[[3qly]], [[Resolution\|resolution]] 2.52Å' scene=''>
	== Structural highlights ==		== Structural highlights ==
-	<table><tr><td colspan='2'>[[3qly]] is a 2 chain structure with sequence from [~~http~~://en.wikipedia.org/wiki/Atcc_2001 Atcc 2001]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA]. For a <b>guided tour on the structure components</b> use [~~http~~://~~oca~~.~~weizmann.ac.il/oca-docs~~/fgij/fg.htm?mol=3QLY FirstGlance]. <br>	+	<table><tr><td colspan='2'>[[3qly]] is a 2 chain structure with sequence from [https://en.wikipedia.org/wiki/Atcc_2001 Atcc 2001]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3QLY FirstGlance]. <br>
-	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=55V:6-METHYL-5-[3-METHYL-3-(3,4,5-TRIMETHOXYPHENYL)BUT-1-YN-1-YL]PYRIMIDINE-2,4-DIAMINE'>55V</scene>, <scene name='pdbligand=NDP:NADPH+DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NDP</scene></td></tr>	+	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=55V:6-METHYL-5-[3-METHYL-3-(3,4,5-TRIMETHOXYPHENYL)BUT-1-YN-1-YL]PYRIMIDINE-2,4-DIAMINE'>55V</scene>, <scene name='pdbligand=NDP:NADPH+DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NDP</scene></td></tr>
-	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3eej\|3eej]], [[3eek\|3eek]], [[3eel\|3eel]], [[3eem\|3eem]], [[3cse\|3cse]]</td></tr>	+	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat"><div style='overflow: auto; max-height: 3em;'>[[3eej\|3eej]], [[3eek\|3eek]], [[3eel\|3eel]], [[3eem\|3eem]], [[3cse\|3cse]]</div></td></tr>
-	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">CAGL0J03894g, DHFR ([~~http~~://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5478 ATCC 2001])</td></tr>	+	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">CAGL0J03894g, DHFR ([https://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5478 ATCC 2001])</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=3qly FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3qly OCA], [~~http~~://pdbe.org/3qly PDBe], [~~http~~://www.rcsb.org/pdb/explore.do?structureId=3qly RCSB], [~~http~~://www.ebi.ac.uk/pdbsum/3qly PDBsum], [~~http~~://prosat.h-its.org/prosat/prosatexe?pdbcode=3qly 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=3qly FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3qly OCA], [https://pdbe.org/3qly PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3qly RCSB], [https://www.ebi.ac.uk/pdbsum/3qly PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3qly ProSAT]</span></td></tr>
	</table>		</table>
	<div style="background-color:#fffaf0;">		<div style="background-color:#fffaf0;">
Line 23:		Line 23:
	</StructureSection>		</StructureSection>
	[[Category: Atcc 2001]]		[[Category: Atcc 2001]]
		+	[[Category: Large Structures]]
	[[Category: Anderson, A C]]		[[Category: Anderson, A C]]
	[[Category: Bendel, S D]]		[[Category: Bendel, S D]]

OCA at 17:30, 11 August 2016

2016-08-11T17:30:20Z

←Older revision		Revision as of 17:30, 11 August 2016
Line 1:		Line 1:
		+
	==Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)==		==Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)==
	<StructureSection load='3qly' size='340' side='right' caption='[[3qly]], [[Resolution\|resolution]] 2.52Å' scene=''>		<StructureSection load='3qly' size='340' side='right' caption='[[3qly]], [[Resolution\|resolution]] 2.52Å' scene=''>
Line 6:		Line 7:
	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3eej\|3eej]], [[3eek\|3eek]], [[3eel\|3eel]], [[3eem\|3eem]], [[3cse\|3cse]]</td></tr>		<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3eej\|3eej]], [[3eek\|3eek]], [[3eel\|3eel]], [[3eem\|3eem]], [[3cse\|3cse]]</td></tr>
	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">CAGL0J03894g, DHFR ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5478 ATCC 2001])</td></tr>		<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">CAGL0J03894g, DHFR ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5478 ATCC 2001])</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=3qly FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3qly OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3qly RCSB], [http://www.ebi.ac.uk/pdbsum/3qly 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=3qly FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3qly OCA], [http://pdbe.org/3qly PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=3qly RCSB], [http://www.ebi.ac.uk/pdbsum/3qly PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=3qly 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 3qly" style="background-color:#fffaf0;"></div>
	== References ==		== References ==
	<references/>		<references/>

OCA at 11:47, 20 January 2015

2015-01-20T11:47:53Z

←Older revision		Revision as of 11:47, 20 January 2015
Line 1:		Line 1:
-	~~{{STRUCTURE_3qly\| PDB=3qly \| SCENE= }}~~	+	==Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)==
-	===Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)===	+	<StructureSection load='3qly' size='340' side='right' caption='[[3qly]], [[Resolution\|resolution]] 2.52Å' scene=''>
-	~~{{ABSTRACT_PUBMED_21726415}}~~	+	== Structural highlights ==
		+	<table><tr><td colspan='2'>[[3qly]] is a 2 chain structure with sequence from [http://en.wikipedia.org/wiki/Atcc_2001 Atcc 2001]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=3QLY FirstGlance]. <br>
		+	</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand\|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=55V:6-METHYL-5-[3-METHYL-3-(3,4,5-TRIMETHOXYPHENYL)BUT-1-YN-1-YL]PYRIMIDINE-2,4-DIAMINE'>55V</scene>, <scene name='pdbligand=NDP:NADPH+DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE+PHOSPHATE'>NDP</scene></td></tr>
		+	<tr id='related'><td class="sblockLbl"><b>[[Related_structure\|Related:]]</b></td><td class="sblockDat">[[3eej\|3eej]], [[3eek\|3eek]], [[3eel\|3eel]], [[3eem\|3eem]], [[3cse\|3cse]]</td></tr>
		+	<tr id='gene'><td class="sblockLbl"><b>[[Gene\|Gene:]]</b></td><td class="sblockDat">CAGL0J03894g, DHFR ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=5478 ATCC 2001])</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=3qly FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3qly OCA], [http://www.rcsb.org/pdb/explore.do?structureId=3qly RCSB], [http://www.ebi.ac.uk/pdbsum/3qly PDBsum]</span></td></tr>
		+	</table>
		+	<div style="background-color:#fffaf0;">
		+	== Publication Abstract from PubMed ==
		+	Candida albicans and Candida glabrata cause fungal bloodstream infections that are associated with significant mortality. As part of an effort to develop potent and selective antifolates that target dihydrofolate reductase (DHFR) from Candida species, we report three ternary crystal structures of Candida albicans DHFR (CaDHFR) bound to novel propargyl-linked analogs. Consistent with earlier modeling results, these structures show that hydrophobic pockets in the binding site may be exploited to increase ligand potency. The crystal structures also confirm that loop residues Thr 58- Phe 66, which flank the active site and influence ligand potency and selectivity, adopt multiple conformations. To aid the development of a dual Candida spp. inhibitor, three new crystal structures of C. glabrata DHFR (CgDHFR) bound to similar ligands as those bound in the ternary structures of CaDHFR are also reported here. Loop residues 58-66 in CgDHFR and human DHFR are 1 A and 3 A closer to the folate binding site, respectively, than loop residues in CaDHFR, suggesting that a properly size ligand could be a potent and selective dual inhibitor of CaDHFR and CgDHFR.

-	~~==About this Structure==~~	+	Crystal structures of Candida albicans dihydrofolate reductase bound to propargyl-linked antifolates reveal the flexibility of active site loop residues critical for ligand potency and selectivity.,Paulsen JL, Bendel SD, Anderson AC Chem Biol Drug Des. 2011 Jul 5. doi: 10.1111/j.1747-0285.2011.01169.x. PMID:21726415<ref>PMID:21726415</ref>
-	~~[[3qly]] is a 2 chain structure with sequence from [http://en~~.~~wikipedia~~.~~org/wiki/Atcc_2001 Atcc 2001]~~. ~~Full crystallographic information is available from [http~~:/~~/oca~~.~~weizmann~~.ac.il/~~oca-bin/ocashort?id=3QLY OCA].~~	+

-	==~~Reference~~==	+	From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>
-	~~<ref group="xtra">PMID:021726415</ref>~~<references ~~group="xtra"~~/><~~references~~/>	+	</div>
		+	== References ==
		+	<references/>
		+	__TOC__
		+	</StructureSection>
	[[Category: Atcc 2001]]		[[Category: Atcc 2001]]
-	[[Category: Anderson, A C.]]	+	[[Category: Anderson, A C]]
-	[[Category: Bendel, S D.]]	+	[[Category: Bendel, S D]]
-	[[Category: Paulsen, J L.]]	+	[[Category: Paulsen, J L]]
	[[Category: Antifungal agent]]		[[Category: Antifungal agent]]
	[[Category: Candida glabrata]]		[[Category: Candida glabrata]]

OCA at 12:14, 20 November 2013

2013-11-20T12:14:19Z

←Older revision		Revision as of 12:14, 20 November 2013
Line 1:		Line 1:
-	[[Image:3qly.png\|left\|200px]]
-
-	<!--
-	The line below this paragraph, containing "STRUCTURE_3qly", 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_3qly\| PDB=3qly \| SCENE= }}		{{STRUCTURE_3qly\| PDB=3qly \| SCENE= }}
-
	===Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)===		===Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)===
-
-
-	<!--
-	The line below this paragraph, {{ABSTRACT_PUBMED_21726415}}, adds the Publication Abstract to the page
-	(as it appears on PubMed at http://www.pubmed.gov), where 21726415 is the PubMed ID number.
-	-->
	{{ABSTRACT_PUBMED_21726415}}		{{ABSTRACT_PUBMED_21726415}}

	==About this Structure==		==About this Structure==
-	[[3qly]] is a 2 chain structure with sequence from [http://en.wikipedia.org/wiki/~~Candida_glabrata Candida glabrata~~]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA].	+	[[3qly]] is a 2 chain structure with sequence from [http://en.wikipedia.org/wiki/Atcc_2001 Atcc 2001]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA].

	==Reference==		==Reference==
-	<ref group="xtra">PMID:021726415</ref><references group="xtra"/>	+	<ref group="xtra">PMID:021726415</ref><references group="xtra"/><references/>
-	[[Category: ~~Candida glabrata~~]]	+	[[Category: Atcc 2001]]
	[[Category: Anderson, A C.]]		[[Category: Anderson, A C.]]
	[[Category: Bendel, S D.]]		[[Category: Bendel, S D.]]

OCA at 06:15, 27 July 2011

2011-07-27T06:15:04Z

←Older revision		Revision as of 06:15, 27 July 2011
Line 1:		Line 1:
-	[[Image:3qly.~~jpg~~\|left\|200px]]	+	[[Image:3qly.png\|left\|200px]]

	<!--		<!--

OCA at 06:41, 20 July 2011

2011-07-20T06:41:14Z

←Older revision		Revision as of 06:41, 20 July 2011
Line 1:		Line 1:
-	~~'''Unreleased structure'''~~	+	[[Image:3qly.jpg\|left\|200px]]

-	The ~~entry 3qly~~ is ~~ON HOLD~~ ~~until Paper Publication~~	+	<!--
		+	The line below this paragraph, containing "STRUCTURE_3qly", 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_3qly\| PDB=3qly \| SCENE= }}

-	~~Authors: Paulsen~~, ~~J.L.~~, ~~Bendel~~, ~~S.D., Anderson, A.C.~~	+	===Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)===

-	~~Description: Candida glabrata dihydrofolate reductase complexed with NADPH and 6~~-~~methyl~~-~~5-[3-methyl-3-(3~~,4,~~5-trimethoxyphenyl~~)~~but~~-1-~~yn-1-yl~~]~~pyrimidine-~~2,4-~~diamine (UCP115A)~~	+
		+	<!--
		+	The line below this paragraph, {{ABSTRACT_PUBMED_21726415}}, adds the Publication Abstract to the page
		+	(as it appears on PubMed at http://www.pubmed.gov), where 21726415 is the PubMed ID number.
		+	-->
		+	{{ABSTRACT_PUBMED_21726415}}
		+
		+	==About this Structure==
		+	[[3qly]] is a 2 chain structure with sequence from [http://en.wikipedia.org/wiki/Candida_glabrata Candida glabrata]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3QLY OCA].
		+
		+	==Reference==
		+	<ref group="xtra">PMID:021726415</ref><references group="xtra"/>
		+	[[Category: Candida glabrata]]
		+	[[Category: Anderson, A C.]]
		+	[[Category: Bendel, S D.]]
		+	[[Category: Paulsen, J L.]]
		+	[[Category: Antifungal agent]]
		+	[[Category: Candida glabrata]]
		+	[[Category: Drug design]]
		+	[[Category: Enzyme inhibitor]]
		+	[[Category: Fungal protein]]
		+	[[Category: Model]]
		+	[[Category: Molecular structure]]
		+	[[Category: Oxidoreductase-oxidoreductase inhibitor complex]]
		+	[[Category: Structure-activity relationship]]
		+	[[Category: Tetrahydrofolate dehydrogenase]]

OCA at 09:38, 23 February 2011

2011-02-23T09:38:45Z

←Older revision		Revision as of 09:38, 23 February 2011
Line 1:		Line 1:
	'''Unreleased structure'''		'''Unreleased structure'''

-	The entry 3qly is ON HOLD	+	The entry 3qly is ON HOLD until Paper Publication

	Authors: Paulsen, J.L., Bendel, S.D., Anderson, A.C.		Authors: Paulsen, J.L., Bendel, S.D., Anderson, A.C.

	Description: Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)		Description: Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)

OCA: Protected "3qly" [edit=sysop:move=sysop]

2011-02-09T05:52:05Z

Protected "3qly" [edit=sysop:move=sysop]

←Older revision

Revision as of 05:52, 9 February 2011

OCA: New page: '''Unreleased structure''' The entry 3qly is ON HOLD Authors: Paulsen, J.L., Bendel, S.D., Anderson, A.C. Description: Candida glabrata dihydrofolate reductase complexed with NADPH and...

2011-02-09T05:52:04Z

New page: '''Unreleased structure''' The entry 3qly is ON HOLD Authors: Paulsen, J.L., Bendel, S.D., Anderson, A.C. Description: Candida glabrata dihydrofolate reductase complexed with NADPH and...

New page

'''Unreleased structure'''

The entry 3qly is ON HOLD

Authors: Paulsen, J.L., Bendel, S.D., Anderson, A.C.

Description: Candida glabrata dihydrofolate reductase complexed with NADPH and 6-methyl-5-[3-methyl-3-(3,4,5-trimethoxyphenyl)but-1-yn-1-yl]pyrimidine-2,4-diamine (UCP115A)