2xru

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[[Image:2xru.png|left|200px]]
 
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{{STRUCTURE_2xru| PDB=2xru | SCENE= }}
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==AURORA-A T288E COMPLEXED WITH PHA-828300==
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<StructureSection load='2xru' size='340' side='right'caption='[[2xru]], [[Resolution|resolution]] 2.90&Aring;' scene=''>
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== Structural highlights ==
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<table><tr><td colspan='2'>[[2xru]] 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=2XRU OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=2XRU FirstGlance]. <br>
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</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 2.9&#8491;</td></tr>
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<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=400:3-({[4-(4-METHYLPIPERAZIN-1-YL)PHENYL]CARBONYL}AMINO)-N-[(1R)-1-PHENYLPROPYL]-1H-THIENO[3,2-C]PYRAZOLE-5-CARBOXAMIDE'>400</scene></td></tr>
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<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=2xru FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xru OCA], [https://pdbe.org/2xru PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=2xru RCSB], [https://www.ebi.ac.uk/pdbsum/2xru PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=2xru ProSAT]</span></td></tr>
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</table>
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== Function ==
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[https://www.uniprot.org/uniprot/AURKA_HUMAN AURKA_HUMAN] Mitotic serine/threonine kinases that contributes to the regulation of cell cycle progression. Associates with the centrosome and the spindle microtubules during mitosis and plays a critical role in various mitotic events including the establishment of mitotic spindle, centrosome duplication, centrosome separation as well as maturation, chromosomal alignment, spindle assembly checkpoint, and cytokinesis. Required for initial activation of CDK1 at centrosomes. Phosphorylates numerous target proteins, including ARHGEF2, BORA, BRCA1, CDC25B, DLGP5, HDAC6, KIF2A, LATS2, NDEL1, PARD3, PPP1R2, PLK1, RASSF1, TACC3, p53/TP53 and TPX2. Regulates KIF2A tubulin depolymerase activity. Required for normal axon formation. Plays a role in microtubule remodeling during neurite extension. Important for microtubule formation and/or stabilization. Also acts as a key regulatory component of the p53/TP53 pathway, and particularly the checkpoint-response pathways critical for oncogenic transformation of cells, by phosphorylating and stabilizing p53/TP53. Phosphorylates its own inhibitors, the protein phosphatase type 1 (PP1) isoforms, to inhibit their activity. Necessary for proper cilia disassembly prior to mitosis.<ref>PMID:9606188</ref> <ref>PMID:11039908</ref> <ref>PMID:11551964</ref> <ref>PMID:12390251</ref> <ref>PMID:13678582</ref> <ref>PMID:14523000</ref> <ref>PMID:15147269</ref> <ref>PMID:14990569</ref> <ref>PMID:15128871</ref> <ref>PMID:14702041</ref> <ref>PMID:15987997</ref> <ref>PMID:18056443</ref> <ref>PMID:17604723</ref> <ref>PMID:17360485</ref> <ref>PMID:18615013</ref> <ref>PMID:19812038</ref> <ref>PMID:19351716</ref> <ref>PMID:19668197</ref> <ref>PMID:19357306</ref> <ref>PMID:20643351</ref> <ref>PMID:17125279</ref>
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== Evolutionary Conservation ==
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[[Image:Consurf_key_small.gif|200px|right]]
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Check<jmol>
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<jmolCheckbox>
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<scriptWhenChecked>; select protein; define ~consurf_to_do selected; consurf_initial_scene = true; script "/wiki/ConSurf/xr/2xru_consurf.spt"</scriptWhenChecked>
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<scriptWhenUnchecked>script /wiki/extensions/Proteopedia/spt/initialview01.spt</scriptWhenUnchecked>
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<text>to colour the structure by Evolutionary Conservation</text>
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</jmolCheckbox>
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</jmol>, as determined by [http://consurfdb.tau.ac.il/ ConSurfDB]. You may read the [[Conservation%2C_Evolutionary|explanation]] of the method and the full data available from [http://bental.tau.ac.il/new_ConSurfDB/main_output.php?pdb_ID=2xru ConSurf].
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<div style="clear:both"></div>
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<div style="background-color:#fffaf0;">
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== Publication Abstract from PubMed ==
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A novel series of 3-amino-1H-thieno[3,2-c]pyrazole derivatives demonstrating high potency in inhibiting Aurora kinases was developed. Here we describe the synthesis and a preliminary structure-activity relationship, which led to the discovery of a representative compound (38), which showed low nanomolar inhibitory activity in the anti-proliferation assay and was able to block the cell cycle in HCT-116 cell line. This compound demonstrated favorable pharmacokinetic properties and good efficacy in the HL-60 xenograft tumor model.
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===AURORA-A T288E COMPLEXED WITH PHA-828300===
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Thieno[3,2-c]pyrazoles: a novel class of Aurora inhibitors with favorable antitumor activity.,Bindi S, Fancelli D, Alli C, Berta D, Bertrand JA, Cameron AD, Cappella P, Carpinelli P, Cervi G, Croci V, D'Anello M, Forte B, Giorgini ML, Marsiglio A, Moll J, Pesenti E, Pittala V, Pulici M, Riccardi-Sirtori F, Roletto F, Soncini C, Storici P, Varasi M, Volpi D, Zugnoni P, Vianello P Bioorg Med Chem. 2010 Oct 1;18(19):7113-20. Epub 2010 Jul 25. PMID:20817473<ref>PMID:20817473</ref>
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{{ABSTRACT_PUBMED_20817473}}
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
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</div>
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<div class="pdbe-citations 2xru" style="background-color:#fffaf0;"></div>
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==About this Structure==
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==See Also==
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[[2xru]] 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=2XRU OCA].
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*[[Serine/threonine protein kinase 3D structures|Serine/threonine protein kinase 3D structures]]
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== References ==
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==Reference==
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<references/>
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<ref group="xtra">PMID:020817473</ref><references group="xtra"/>
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__TOC__
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</StructureSection>
[[Category: Homo sapiens]]
[[Category: Homo sapiens]]
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[[Category: Non-specific serine/threonine protein kinase]]
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[[Category: Large Structures]]
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[[Category: Alli, C.]]
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[[Category: Alli C]]
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[[Category: Anello, M D.]]
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[[Category: Berta D]]
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[[Category: Berta, D.]]
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[[Category: Bertrand JA]]
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[[Category: Bertrand, J A.]]
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[[Category: Bindi S]]
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[[Category: Bindi, S.]]
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[[Category: Cameron AD]]
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[[Category: Cameron, A D.]]
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[[Category: Cappella P]]
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[[Category: Cappella, P.]]
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[[Category: Carpinelli P]]
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[[Category: Carpinelli, P.]]
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[[Category: Cervi G]]
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[[Category: Cervi, G.]]
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[[Category: Croci W]]
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[[Category: Croci, W.]]
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[[Category: D'Anello M]]
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[[Category: Fancelli, D.]]
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[[Category: Fancelli D]]
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[[Category: Forte, B.]]
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[[Category: Forte B]]
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[[Category: Lauragiorgini, M.]]
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[[Category: LauraGiorgini M]]
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[[Category: Marsiglio, A.]]
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[[Category: Marsiglio A]]
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[[Category: Moll, J.]]
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[[Category: Moll J]]
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[[Category: Pesenti, E.]]
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[[Category: Pesenti E]]
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[[Category: Pittala, V.]]
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[[Category: Pittala V]]
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[[Category: Pulici, M.]]
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[[Category: Pulici M]]
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[[Category: Riccardi-Sirtori, F.]]
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[[Category: Riccardi-Sirtori F]]
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[[Category: Roletto, F.]]
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[[Category: Roletto F]]
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[[Category: Soncini, C.]]
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[[Category: Soncini C]]
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[[Category: Storici, P.]]
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[[Category: Storici P]]
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[[Category: Varasi, M.]]
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[[Category: Varasi M]]
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[[Category: Vianello, P.]]
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[[Category: Vianello P]]
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[[Category: Volpi, D.]]
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[[Category: Volpi D]]
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[[Category: Zugnoni, P.]]
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[[Category: Zugnoni P]]
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[[Category: Cell cycle]]
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[[Category: Kinase]]
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[[Category: Nucleotide-binding]]
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[[Category: Transferase]]
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Current revision

AURORA-A T288E COMPLEXED WITH PHA-828300

PDB ID 2xru

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