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7QG7

SARS-CoV-2 macrodomain Nsp3b bound to the remdesivir nucleoside GS-441524

Summary for 7QG7
Entry DOI10.2210/pdb7qg7/pdb
DescriptorPapain-like protease nsp3, (2~{R},3~{R},4~{S},5~{R})-2-(4-azanylpyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolane-2-carbonitrile, 1,2-ETHANEDIOL, ... (4 entities in total)
Functional Keywordsnsp3, macrodomain, sars-cov-2, remdesivir, gs-441524, covid-19, viral protein, drug discovery
Biological sourceSevere acute respiratory syndrome coronavirus 2
Total number of polymer chains2
Total formula weight38245.61
Authors
Wollenhaupt, J.,Linhard, V.,Sreeramulu, S.,Weiss, M.S.,Schwalbe, H. (deposition date: 2021-12-07, release date: 2021-12-15, Last modification date: 2024-01-31)
Primary citationTsika, A.C.,Gallo, A.,Fourkiotis, N.K.,Argyriou, A.I.,Sreeramulu, S.,Lohr, F.,Rogov, V.V.,Richter, C.,Linhard, V.,Gande, S.L.,Altincekic, N.,Krishnathas, R.,Elamri, I.,Schwalbe, H.,Wollenhaupt, J.,Weiss, M.S.,Spyroulias, G.A.
Binding Adaptation of GS-441524 Diversifies Macro Domains and Downregulates SARS-CoV-2 de-MARylation Capacity.
J.Mol.Biol., 434:167720-167720, 2022
Cited by
PubMed: 35839840
DOI: 10.1016/j.jmb.2022.167720
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.72 Å)
Structure validation

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