9ep8

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Current revision (05:19, 25 September 2024) (edit) (undo)
 
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'''Unreleased structure'''
 
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The entry 9ep8 is ON HOLD until Paper Publication
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==Crystal structure of ROCK2 in complex with a 8-(azaindolyl)-benzoazepinone inhibitor==
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<StructureSection load='9ep8' size='340' side='right'caption='[[9ep8]], [[Resolution|resolution]] 2.63&Aring;' scene=''>
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Authors: Pala, D., Clark, D., Pioselli, B., Accetta, A., Rancati, F.
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== Structural highlights ==
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<table><tr><td colspan='2'>[[9ep8]] is a 4 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=9EP8 OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=9EP8 FirstGlance]. <br>
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Description: Crystal structure of ROCK2 in complex with a 8-(azaindolyl)-benzoazepinone inhibitor
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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]] 2.63&#8491;</td></tr>
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[[Category: Unreleased Structures]]
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<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=A1H6L:3-phenyl-7-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)-2,5-dihydro-1~{H}-3-benzazepin-4-one'>A1H6L</scene>, <scene name='pdbligand=EDO:1,2-ETHANEDIOL'>EDO</scene></td></tr>
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[[Category: Pala, D]]
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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=9ep8 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=9ep8 OCA], [https://pdbe.org/9ep8 PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=9ep8 RCSB], [https://www.ebi.ac.uk/pdbsum/9ep8 PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=9ep8 ProSAT]</span></td></tr>
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[[Category: Clark, D]]
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</table>
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[[Category: Rancati, F]]
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== Function ==
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[[Category: Accetta, A]]
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[https://www.uniprot.org/uniprot/ROCK2_HUMAN ROCK2_HUMAN] Protein kinase which is a key regulator of actin cytoskeleton and cell polarity. Involved in regulation of smooth muscle contraction, actin cytoskeleton organization, stress fiber and focal adhesion formation, neurite retraction, cell adhesion and motility via phosphorylation of ADD1, BRCA2, CNN1, EZR, DPYSL2, EP300, MSN, MYL9/MLC2, NPM1, RDX, PPP1R12A and VIM. Phosphorylates SORL1 and IRF4. Acts as a negative regulator of VEGF-induced angiogenic endothelial cell activation. Positively regulates the activation of p42/MAPK1-p44/MAPK3 and of p90RSK/RPS6KA1 during myogenic differentiation. Plays an important role in the timely initiation of centrosome duplication. Inhibits keratinocyte terminal differentiation. May regulate closure of the eyelids and ventral body wall through organization of actomyosin bundles. Plays a critical role in the regulation of spine and synaptic properties in the hippocampus.<ref>PMID:10579722</ref> <ref>PMID:15699075</ref> <ref>PMID:16574662</ref> <ref>PMID:17015463</ref> <ref>PMID:19131646</ref> <ref>PMID:19997641</ref> <ref>PMID:21084279</ref> <ref>PMID:21147781</ref>
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[[Category: Pioselli, B]]
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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: Homo sapiens]]
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[[Category: Large Structures]]
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[[Category: Accetta A]]
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[[Category: Clark D]]
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[[Category: Pala D]]
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[[Category: Pioselli B]]
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[[Category: Rancati F]]

Current revision

Crystal structure of ROCK2 in complex with a 8-(azaindolyl)-benzoazepinone inhibitor

PDB ID 9ep8

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