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1p9u

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[[Image:1p9u.png|left|200px]]
 
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{{STRUCTURE_1p9u| PDB=1p9u | SCENE= }}
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==Coronavirus Main Proteinase (3CLpro) Structure: Basis for Design of anti-SARS Drugs==
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<StructureSection load='1p9u' size='340' side='right'caption='[[1p9u]], [[Resolution|resolution]] 2.37&Aring;' scene=''>
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===Coronavirus Main Proteinase (3CLpro) Structure: Basis for Design of anti-SARS Drugs===
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== Structural highlights ==
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<table><tr><td colspan='2'>[[1p9u]] is a 8 chain structure with sequence from [https://en.wikipedia.org/wiki/Transmissible_gastroenteritis_virus Transmissible gastroenteritis virus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1P9U OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=1P9U FirstGlance]. <br>
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{{ABSTRACT_PUBMED_12746549}}
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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]] 2.37&#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=0QE:CHLOROMETHANE'>0QE</scene>, <scene name='pdbligand=MRD:(4R)-2-METHYLPENTANE-2,4-DIOL'>MRD</scene>, <scene name='pdbligand=PHQ:BENZYL+CHLOROCARBONATE'>PHQ</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</scene></td></tr>
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==About this Structure==
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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=1p9u FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=1p9u OCA], [https://pdbe.org/1p9u PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=1p9u RCSB], [https://www.ebi.ac.uk/pdbsum/1p9u PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=1p9u ProSAT]</span></td></tr>
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[[1p9u]] is a 8 chain structure with sequence from [http://en.wikipedia.org/wiki/Transmissible_gastroenteritis_virus Transmissible gastroenteritis virus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1P9U OCA].
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</table>
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== Function ==
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==Reference==
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[https://www.uniprot.org/uniprot/R1AB_CVPPU R1AB_CVPPU] The replicase polyprotein of coronaviruses is a multifunctional protein: it contains the activities necessary for the transcription of negative stranded RNA, leader RNA, subgenomic mRNAs and progeny virion RNA as well as proteinases responsible for the cleavage of the polyprotein into functional products. The papain-like proteinase 1 (PLP1) and papain-like proteinase 2 (PLP2) are responsible for the cleavages located at the N-terminus of the replicase polyprotein. In addition, PLP2 possesses a deubiquitinating/deISGylating activity and processes both 'Lys-48'- and 'Lys-63'-linked polyubiquitin chains from cellular substrates. PLP2 also antagonizes innate immune induction of type I interferon by blocking the nuclear translocation of host IRF-3 (By similarity). The main proteinase 3CL-PRO is responsible for the majority of cleavages as it cleaves the C-terminus of replicase polyprotein at 11 sites. Recognizes substrates containing the core sequence [ILMVF]-Q-|-[SAGC]. Inhibited by the substrate-analog Cbz-Val-Asn-Ser-Thr-Leu-Gln-CMK. The helicase which contains a zinc finger structure displays RNA and DNA duplex-unwinding activities with 5' to 3' polarity. ATPase activity is strongly stimulated by poly(U), poly(dT), poly(C), poly(dA), but not by poly(G). The exoribonuclease acts on both ssRNA and dsRNA in a 3' to 5' direction (By similarity). Nsp7-nsp8 hexadecamer may possibly confer processivity to the polymerase, maybe by binding to dsRNA or by producing primers utilized by the latter (By similarity). Nsp9 is a ssRNA-binding protein (By similarity). NendoU is a Mn(2+)-dependent, uridylate-specific enzyme, which leaves 2'-3'-cyclic phosphates 5' to the cleaved bond (By similarity).
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<ref group="xtra">PMID:012746549</ref><references group="xtra"/>
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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/p9/1p9u_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=1p9u ConSurf].
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<div style="clear:both"></div>
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__TOC__
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</StructureSection>
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[[Category: Large Structures]]
[[Category: Transmissible gastroenteritis virus]]
[[Category: Transmissible gastroenteritis virus]]
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[[Category: Anand, K.]]
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[[Category: Anand K]]
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[[Category: Hilgenfeld, R.]]
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[[Category: Hilgenfeld R]]
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[[Category: Mesters, J R.]]
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[[Category: Mesters JR]]
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[[Category: Wadhwani, P.]]
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[[Category: Wadhwani P]]
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[[Category: Ziebuhr, J.]]
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[[Category: Ziebuhr J]]
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[[Category: Hcov]]
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[[Category: Hydrolase-hydrolase inhibitor complex]]
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[[Category: Sars-cov]]
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[[Category: Tgev]]
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Current revision

Coronavirus Main Proteinase (3CLpro) Structure: Basis for Design of anti-SARS Drugs

PDB ID 1p9u

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