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Structure methods	All X-ray diffraction NMR electron microscopy small angle scattering neutron diffraction fiber diffraction powder diffraction infrared spectroscopy EPR fluorescence transfer theoretical model Hybrid
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IF	>30 >20 >10 >5 all

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Structure paper

Title	Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking.
Journal, issue, pages	Sci Adv, Vol. 7, Year 2021
Publish date	Sep 28, 2020 (structure data deposition date)
Authors	Schuller, M. / Correy, G.J. / Gahbauer, S. / Fearon, D. / Wu, T. / Diaz, R.E. / Young, I.D. / Carvalho Martins, L. / Smith, D.H. / Schulze-Gahmen, U. ...Schuller, M. / Correy, G.J. / Gahbauer, S. / Fearon, D. / Wu, T. / Diaz, R.E. / Young, I.D. / Carvalho Martins, L. / Smith, D.H. / Schulze-Gahmen, U. / Owens, T.W. / Deshpande, I. / Merz, G.E. / Thwin, A.C. / Biel, J.T. / Peters, J.K. / Moritz, M. / Herrera, N. / Kratochvil, H.T. / Aimon, A. / Bennett, J.M. / Brandao Neto, J. / Cohen, A.E. / Dias, A. / Douangamath, A. / Dunnett, L. / Fedorov, O. / Ferla, M.P. / Fuchs, M.R. / Gorrie-Stone, T.J. / Holton, J.M. / Johnson, M.G. / Krojer, T. / Meigs, G. / Powell, A.J. / Rack, J.G.M. / Rangel, V.L. / Russi, S. / Skyner, R.E. / Smith, C.A. / Soares, A.S. / Wierman, J.L. / Zhu, K. / O'Brien, P. / Jura, N. / Ashworth, A. / Irwin, J.J. / Thompson, M.C. / Gestwicki, J.E. / von Delft, F. / Shoichet, B.K. / Fraser, J.S. / Ahel, I.
External links	Sci Adv / PubMed:33853786
Methods	X-ray diffraction
Resolution	0.77 - 1.55 Å
Structure data	PDB-5rs7: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000034618676 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rs8: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000001601 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5rs9: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000007636250 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsb: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001674697 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsc: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000003888754 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5rsd: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000331945 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rse: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000336438345 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsf: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000026180281 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsg: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000263392672 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsh: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000274438208 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsi: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000374420934 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5rsj: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000089254160_N3 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsk: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000901381520_N3 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsl: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000365052868 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsm: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000001099 Method: X-RAY DIFFRACTION / Resolution: 1.02 Å PDB-5rsn: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000064576 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rso: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000000226 Method: X-RAY DIFFRACTION / Resolution: 1.03 Å PDB-5rsp: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002560357 Method: X-RAY DIFFRACTION / Resolution: 1.02 Å PDB-5rsq: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000158490 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsr: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000158650 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rss: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000006691828 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rst: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000332673 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsu: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000002055 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsv: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000340465 Method: X-RAY DIFFRACTION / Resolution: 1.03 Å PDB-5rsw: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000337835 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsx: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388262 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rsy: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000004787230 Method: X-RAY DIFFRACTION / Resolution: 1.04 Å PDB-5rsz: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000004218283 Method: X-RAY DIFFRACTION / Resolution: 1.02 Å PDB-5rt0: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002582714 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rt1: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000039810 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rt2: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000008652361 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rt3: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000039281982 Method: X-RAY DIFFRACTION / Resolution: 1.05 Å PDB-5rt4: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000051581 Method: X-RAY DIFFRACTION / Resolution: 1.02 Å PDB-5rt5: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000058111 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rt6: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000156509 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rt7: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000015442276 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rt8: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000161908 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rt9: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388280 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5rta: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000332540 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtb: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000006534965 Method: X-RAY DIFFRACTION / Resolution: 1.04 Å PDB-5rtc: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000006490906 Method: X-RAY DIFFRACTION / Resolution: 1.06 Å PDB-5rtd: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000157108 Method: X-RAY DIFFRACTION / Resolution: 1.04 Å PDB-5rte: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000013283576 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtf: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002047514 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtg: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000395673 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5rth: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000156863 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rti: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000004219237 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5rtj: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000332752 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtk: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000164504 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtl: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388056 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtm: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000002005 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtn: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000013514509 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rto: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388302 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtp: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001679336 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtq: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000019015078 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtr: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000018169763 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rts: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000159004 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtt: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000873830 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtu: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000159056 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtv: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001698894 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtw: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000164777 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtx: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000090873 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rty: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000157088 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rtz: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000404062 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru0: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388514 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru1: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000034687 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru2: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000331715 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru3: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000161696 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru4: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001688638 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru5: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000098208711 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru6: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001442764 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru7: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000003591110 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru8: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000154817 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ru9: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000165882 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rua: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000033986325 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruc: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000005878 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rud: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000008615114 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rue: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000000922 Method: X-RAY DIFFRACTION / Resolution: 1.02 Å PDB-5ruf: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000016989831 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rug: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000038389 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruh: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000123600 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rui: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000332651 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruj: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000404314 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5ruk: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000161692 Method: X-RAY DIFFRACTION / Resolution: 1.05 Å PDB-5rul: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000163774 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rum: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000008861082 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5run: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000194295 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruo: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001683100 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rup: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000004976927 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruq: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000032199226 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rur: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000017744334 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rus: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388081 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rut: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000161958 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruu: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000438614 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5ruv: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000019015194 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruw: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000045014941 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rux: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002020050 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruy: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000013517187 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5ruz: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000019685960 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv0: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000039994 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv1: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000251609 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv2: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000311783 Method: X-RAY DIFFRACTION / Resolution: 1.01 Å PDB-5rv3: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000057162 Method: X-RAY DIFFRACTION / Resolution: 1.02 Å PDB-5rv4: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000039224 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv5: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000008578948 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv6: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000158540 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv7: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000003954002 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv8: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000039575 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rv9: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388150 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rva: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000016343276 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rvb: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000014419577 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rvc: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000933940912 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rvd: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000263980802 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rve: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000736709772 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rvf: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000082473428_N3 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rvg: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000400552187_N3 Method: X-RAY DIFFRACTION / Resolution: 1.0 Å PDB-5rvh: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000265642 Method: X-RAY DIFFRACTION / Resolution: 0.98 Å PDB-5rvi: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000084843283 Method: X-RAY DIFFRACTION / Resolution: 0.94 Å PDB-5rvj: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001612349 Method: X-RAY DIFFRACTION / Resolution: 1.2 Å PDB-5rvk: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002977810 Method: X-RAY DIFFRACTION / Resolution: 1.46 Å PDB-5rvl: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000149580 Method: X-RAY DIFFRACTION / Resolution: 1.36 Å PDB-5rvm: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000157088 Method: X-RAY DIFFRACTION / Resolution: 1.03 Å PDB-5rvn: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000332748 Method: X-RAY DIFFRACTION / Resolution: 1.26 Å PDB-5rvo: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000013514509 Method: X-RAY DIFFRACTION / Resolution: 1.52 Å PDB-5rvp: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000154817 Method: X-RAY DIFFRACTION / Resolution: 1.04 Å PDB-5rvq: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002508153 Method: X-RAY DIFFRACTION / Resolution: 1.08 Å PDB-5rvr: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000016052862 Method: X-RAY DIFFRACTION / Resolution: 1.04 Å PDB-5rvs: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000159004 Method: X-RAY DIFFRACTION / Resolution: 1.52 Å PDB-5rvt: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002582714 Method: X-RAY DIFFRACTION / Resolution: 1.26 Å PDB-5rvu: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000002506130 Method: X-RAY DIFFRACTION / Resolution: 1.2 Å PDB-5rvv: PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000020269197 Method: X-RAY DIFFRACTION / Resolution: 1.42 Å PDB-5s18: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-321461 Method: X-RAY DIFFRACTION / Resolution: 1.13 Å PDB-5s1a: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-43406 Method: X-RAY DIFFRACTION / Resolution: 1.079 Å PDB-5s1c: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z3034471507 Method: X-RAY DIFFRACTION / Resolution: 1.174 Å PDB-5s1e: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with AB-601_30915014 Method: X-RAY DIFFRACTION / Resolution: 1.172 Å PDB-5s1g: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-108952 Method: X-RAY DIFFRACTION / Resolution: 1.11 Å PDB-5s1i: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-301084 Method: X-RAY DIFFRACTION / Resolution: 1.068 Å PDB-5s1k: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-105873 Method: X-RAY DIFFRACTION / Resolution: 1.076 Å PDB-5s1m: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with STK497968 Method: X-RAY DIFFRACTION / Resolution: 1.184 Å PDB-5s1o: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with STL414928 Method: X-RAY DIFFRACTION / Resolution: 1.09 Å PDB-5s1q: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-17035 Method: X-RAY DIFFRACTION / Resolution: 1.127 Å PDB-5s1s: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z1613477500 Method: X-RAY DIFFRACTION / Resolution: 1.16 Å PDB-5s1u: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-52144 Method: X-RAY DIFFRACTION / Resolution: 1.08 Å PDB-5s1w: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z838838708 Method: X-RAY DIFFRACTION / Resolution: 1.135 Å PDB-5s1y: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with STK346965 Method: X-RAY DIFFRACTION / Resolution: 1.091 Å PDB-5s20: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with PB1827975385 Method: X-RAY DIFFRACTION / Resolution: 1.037 Å PDB-5s22: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z145120524 Method: X-RAY DIFFRACTION / Resolution: 1.175 Å PDB-5s24: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with EN300-697611 Method: X-RAY DIFFRACTION / Resolution: 1.14 Å PDB-5s26: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z605596346 Method: X-RAY DIFFRACTION / Resolution: 1.125 Å PDB-5s27: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z1262398530 Method: X-RAY DIFFRACTION / Resolution: 1.126 Å PDB-5s28: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z409974522 Method: X-RAY DIFFRACTION / Resolution: 1.09 Å PDB-5s29: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z199959602 Method: X-RAY DIFFRACTION / Resolution: 1.3 Å PDB-5s2a: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z1263529624 Method: X-RAY DIFFRACTION / Resolution: 1.08 Å PDB-5s2b: PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 Nsp3 macrodomain in complex with Z373769142 Method: X-RAY DIFFRACTION / Resolution: 1.11 Å PDB-5s2c: