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8DIE

Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors

Resources
File formatFile name (file size)
PDBx/mmCIF8die.cif.gz Display(127.81 KB)
8die.cif
PDBx/mmJSONall8die.json.gz Display (Tree)(84.71 KB)
8die.json
no-atom8die-noatom.json.gz Display (Header)(16.82 KB)
8die-noatom.json
add only8die-plus.json.gz Display(729.00 B)
8die-plus.json
PDBMLall8die.xml.gz Display(170.89 KB)
8die.xml
no-atom8die-noatom.xml.gz Display(32.85 KB)
8die-noatom.xml
ext-atom8die-extatom.xml.gz Display(102.51 KB)
8die-extatom.xml
pdb_nextgenallpdb_00008die_xyz-enrich.cif.gz Display(139.93 KB)
pdb_00008die_xyz-enrich.cif
no-atompdb_00008die_xyz-no-atom-enrich.xml.gz Display(45.47 KB)
pdb_00008die_xyz-no-atom-enrich.xml
ng-only8die-plus.json.gz Display(3.26 KB)
8die-plus.json
PDBpdb8die.ent.gz Display(96.21 KB)
pdb8die.ent
RDF8die.rdf.gz Visualize(95.10 KB)
8die.rdf
Structure factorsr8diesf.ent.gz Display(1.15 MB)
r8diesf.ent
Biological unit (mmCIF format)8die-assembly1.cif.gz Display(114.63 KB)
8die-assembly1.cif (A,B)

*author and software defined assembly, 2 molecule(s) (dimeric)

Biological unit (PDB format)8die.pdb1.gz Display(91.31 KB)
8die.pdb1 (A,B)

*author and software defined assembly, 2 molecule(s) (dimeric)

Validation reportsPDF8die_validation.pdf.gz Display(1003.95 KB)
8die_validation.pdf
PDF-full8die_full_validation.pdf.gz Display(1010.81 KB)
8die_full_validation.pdf
mmCIF8die_validation.cif.gz Display(31.86 KB)
8die_validation.cif
XML8die_validation.xml.gz Display(23.63 KB)
8die_validation.xml
PNG8die_multipercentile_validation.png.gz Display(168.69 KB)
8die_multipercentile_validation.png
SVG8die_multipercentile_validation.svg.gz Display(977.00 B)
8die_multipercentile_validation.svg
EDMap2fo-fc (PDBx/mmCIF)8die_validation_2fo-fc_map_coef.cif.gz Display(430.64 KB)
8die_validation_2fo-fc_map_coef.cif
fo-fc (PDBx/mmCIF)8die_validation_fo-fc_map_coef.cif.gz Display(422.71 KB)
8die_validation_fo-fc_map_coef.cif
2fo-fc (MTZ)8die_validation_2fo-fc_map_coef.mtz Visualize(1005.04 KB)
fo-fc (MTZ)8die_validation_fo-fc_map_coef.mtz Visualize(1005.04 KB)

227111

PDB entries from 2024-11-06

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