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4n9e
From Proteopedia
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==Fragment-based Design of 3-Aminopyridine-derived Amides as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)== | ==Fragment-based Design of 3-Aminopyridine-derived Amides as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)== | ||
| - | <StructureSection load='4n9e' size='340' side='right' caption='[[4n9e]], [[Resolution|resolution]] 1.72Å' scene=''> | + | <StructureSection load='4n9e' size='340' side='right'caption='[[4n9e]], [[Resolution|resolution]] 1.72Å' scene=''> |
== Structural highlights == | == Structural highlights == | ||
| - | <table><tr><td colspan='2'>[[4n9e]] is a 2 chain structure with sequence from [ | + | <table><tr><td colspan='2'>[[4n9e]] 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=4N9E OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4N9E FirstGlance]. <br> |
| - | </td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=2HL:1-[(1-BENZOYLPIPERIDIN-4-YL)METHYL]-N-(PYRIDIN-3-YL)-1H-BENZIMIDAZOLE-5-CARBOXAMIDE'>2HL</scene>, <scene name='pdbligand=DTT:2,3-DIHYDROXY-1,4-DITHIOBUTANE'>DTT</scene>, <scene name='pdbligand=EDO:1,2-ETHANEDIOL'>EDO</scene>, <scene name='pdbligand=PO4:PHOSPHATE+ION'>PO4</scene | + | </td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 1.72Å</td></tr> |
| - | + | <tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=2HL:1-[(1-BENZOYLPIPERIDIN-4-YL)METHYL]-N-(PYRIDIN-3-YL)-1H-BENZIMIDAZOLE-5-CARBOXAMIDE'>2HL</scene>, <scene name='pdbligand=DTT:2,3-DIHYDROXY-1,4-DITHIOBUTANE'>DTT</scene>, <scene name='pdbligand=EDO:1,2-ETHANEDIOL'>EDO</scene>, <scene name='pdbligand=PO4:PHOSPHATE+ION'>PO4</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=4n9e FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4n9e OCA], [https://pdbe.org/4n9e PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4n9e RCSB], [https://www.ebi.ac.uk/pdbsum/4n9e PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4n9e ProSAT]</span></td></tr> | |
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| - | <tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[ | + | |
</table> | </table> | ||
== Function == | == Function == | ||
| - | [ | + | [https://www.uniprot.org/uniprot/NAMPT_HUMAN NAMPT_HUMAN] Catalyzes the condensation of nicotinamide with 5-phosphoribosyl-1-pyrophosphate to yield nicotinamide mononucleotide, an intermediate in the biosynthesis of NAD. It is the rate limiting component in the mammalian NAD biosynthesis pathway (By similarity). |
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==See Also== | ==See Also== | ||
| - | *[[Phosphoribosyltransferase|Phosphoribosyltransferase]] | + | *[[Phosphoribosyltransferase 3D structures|Phosphoribosyltransferase 3D structures]] |
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__TOC__ | __TOC__ | ||
</StructureSection> | </StructureSection> | ||
| - | [[Category: | + | [[Category: Homo sapiens]] |
| - | [[Category: | + | [[Category: Large Structures]] |
| - | [[Category: Baumeister | + | [[Category: Baumeister T]] |
| - | [[Category: Bravo | + | [[Category: Bravo B]] |
| - | + | [[Category: Dragovich PS]] | |
| - | [[Category: Dragovich | + | [[Category: Giannetti AM]] |
| - | [[Category: Giannetti | + | [[Category: Ho Y]] |
| - | [[Category: Ho | + | [[Category: Hua R]] |
| - | [[Category: Hua | + | [[Category: Li G]] |
| - | [[Category: Li | + | [[Category: Liang X]] |
| - | [[Category: Liang | + | [[Category: O'Brien T]] |
| - | [[Category: Oh | + | [[Category: Oh A]] |
| - | [[Category: Skelton | + | [[Category: Skelton NJ]] |
| - | [[Category: Wang | + | [[Category: Wang C]] |
| - | [[Category: Wang | + | [[Category: Wang W]] |
| - | [[Category: Wang | + | [[Category: Wang Y]] |
| - | [[Category: Xiao | + | [[Category: Xiao Y]] |
| - | [[Category: Yuen | + | [[Category: Yuen P]] |
| - | [[Category: Zak | + | [[Category: Zak M]] |
| - | [[Category: Zhao | + | [[Category: Zhao G]] |
| - | [[Category: Zhao | + | [[Category: Zhao Q]] |
| - | [[Category: Zheng | + | [[Category: Zheng X]] |
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Current revision
Fragment-based Design of 3-Aminopyridine-derived Amides as Potent Inhibitors of Human Nicotinamide Phosphoribosyltransferase (NAMPT)
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Categories: Homo sapiens | Large Structures | Baumeister T | Bravo B | Dragovich PS | Giannetti AM | Ho Y | Hua R | Li G | Liang X | O'Brien T | Oh A | Skelton NJ | Wang C | Wang W | Wang Y | Xiao Y | Yuen P | Zak M | Zhao G | Zhao Q | Zheng X
