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5g6p

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'''Unreleased structure'''
 
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The entry 5g6p is ON HOLD until Paper Publication
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==Structure of Bacillus subtilis Nitric Oxide Synthase I218V in complex with 7-((4-(Dimethylamino)methyl)phenoxy)methyl)quinolin-2- amine==
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<StructureSection load='5g6p' size='340' side='right' caption='[[5g6p]], [[Resolution|resolution]] 2.18&Aring;' scene=''>
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== Structural highlights ==
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<table><tr><td colspan='2'>[[5g6p]] is a 1 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=5G6P OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5G6P FirstGlance]. <br>
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</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=8VJ:7-[[4-[(DIMETHYLAMINO)METHYL]PHENOXY]METHYL]QUINOLIN-2-AMINE'>8VJ</scene>, <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=GOL:GLYCEROL'>GOL</scene>, <scene name='pdbligand=HEM:PROTOPORPHYRIN+IX+CONTAINING+FE'>HEM</scene></td></tr>
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<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[5g65|5g65]], [[5g66|5g66]], [[5g67|5g67]], [[5g68|5g68]], [[5g69|5g69]], [[5g6a|5g6a]], [[5g6b|5g6b]], [[5g6c|5g6c]], [[5g6d|5g6d]], [[5g6e|5g6e]], [[5g6f|5g6f]], [[5g6g|5g6g]], [[5g6h|5g6h]], [[5g6i|5g6i]], [[5g6j|5g6j]], [[5g6k|5g6k]], [[5g6l|5g6l]], [[5g6m|5g6m]], [[5g6n|5g6n]], [[5g6o|5g6o]], [[5g6q|5g6q]]</td></tr>
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<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Nitric-oxide_synthase_(NAD(P)H-dependent) Nitric-oxide synthase (NAD(P)H-dependent)], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.14.13.165 1.14.13.165] </span></td></tr>
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<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=5g6p FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=5g6p OCA], [http://pdbe.org/5g6p PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=5g6p RCSB], [http://www.ebi.ac.uk/pdbsum/5g6p PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=5g6p ProSAT]</span></td></tr>
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</table>
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== Function ==
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[[http://www.uniprot.org/uniprot/NOSO_BACSU NOSO_BACSU]] Catalyzes the production of nitric oxide.
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<div style="background-color:#fffaf0;">
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== Publication Abstract from PubMed ==
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Nitric oxide (NO) is produced in Gram-positive pathogens Bacillus anthracis and Staphylococcus aureus by the bacterial isoform of nitric oxide synthase (NOS). Inhibition of bacterial nitric oxide synthase (bNOS) has been identified as a promising antibacterial strategy for targeting methicillin-resistant Staphylocoocus aureus1. One class of NOS inhibitors that demonstrates antimicrobial efficacy utilizes an aminoquinoline scaffold. Here we report on a variety of aminoquinolines that target the bacterial NOS active site, in part, by binding to a hydrophobic patch that is unique to bNOS. Through mutagenesis and crystallographic studies, our findings demonstrate that aminoquinolines are an excellent scaffold to further aid in the development of bNOS-specific inhibitors.
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Authors: Holden, J.K., Poulos, T.L.
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Targeting Bacterial Nitric Oxide Synthase with Aminoquinoline-based Inhibitors.,Holden JK, Lewis MC, Cinelli MA, Abdullatif Z, Pensa AV, Silverman RB, Poulos TL Biochemistry. 2016 Sep 8. PMID:27607918<ref>PMID:27607918</ref>
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Description: Structure of Bacillus subtilis Nitric Oxide Synthase I218V in complex with 7-((4-(Dimethylamino)methyl)phenoxy)methyl)quinolin-2-amine
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
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[[Category: Unreleased Structures]]
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</div>
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[[Category: Poulos, T.L]]
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<div class="pdbe-citations 5g6p" style="background-color:#fffaf0;"></div>
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[[Category: Holden, J.K]]
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== References ==
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<references/>
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__TOC__
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</StructureSection>
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[[Category: Holden, J K]]
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[[Category: Poulos, T L]]
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[[Category: Inhibitor]]
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[[Category: Nitric oxide synthase]]
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[[Category: Oxidoreductase]]

Revision as of 13:50, 21 September 2016

Structure of Bacillus subtilis Nitric Oxide Synthase I218V in complex with 7-((4-(Dimethylamino)methyl)phenoxy)methyl)quinolin-2- amine

5g6p, resolution 2.18Å

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