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5R8T

PanDDA analysis group deposition of ground-state model of SARS-CoV-2 main protease screened against DSI poised (Enamine), Fraglites and Peplites (Newcastle university), Mini Frags (Astex), York 3D (York university), electrophile cysteine covalent (Weizman institute) fragment libraries

Resources
File formatFile name (file size)
PDBx/mmCIF5r8t.cif.gz Display(80.85 KB)
5r8t.cif
PDBx/mmJSONall5r8t.json.gz Display (Tree)(56.89 KB)
5r8t.json
no-atom5r8t-noatom.json.gz Display (Header)(14.79 KB)
5r8t-noatom.json
add only5r8t-plus.json.gz Display(708.00 B)
5r8t-plus.json
PDBMLall5r8t.xml.gz Display(108.76 KB)
5r8t.xml
no-atom5r8t-noatom.xml.gz Display(27.80 KB)
5r8t-noatom.xml
ext-atom5r8t-extatom.xml.gz Display(60.26 KB)
5r8t-extatom.xml
PDBpdb5r8t.ent.gz Display(59.54 KB)
pdb5r8t.ent
RDF5r8t.rdf.gz Visualize(77.44 KB)
5r8t.rdf
Structure factorsr5r8tsf.ent.gz Display(723.71 MB)
r5r8tsf.ent
Biological unit (mmCIF format)5r8t-assembly1.cif.gz Display(135.76 KB)
5r8t-assembly1.cif (A)

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

Biological unit (PDB format)5r8t.pdb1.gz Display(106.47 KB)
5r8t.pdb1 (A)

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

Validation reportsPDF5r8t_validation.pdf.gz Display(438.21 KB)
5r8t_validation.pdf
PDF-full5r8t_full_validation.pdf.gz Display(439.75 KB)
5r8t_full_validation.pdf
mmCIF5r8t_validation.cif.gz Display(24.79 KB)
5r8t_validation.cif
XML5r8t_validation.xml.gz Display(16.38 KB)
5r8t_validation.xml
PNG5r8t_multipercentile_validation.png.gz Display(170.00 KB)
5r8t_multipercentile_validation.png
SVG5r8t_multipercentile_validation.svg.gz Display(979.00 B)
5r8t_multipercentile_validation.svg
EDMap2fo-fc (PDBx/mmCIF)5r8t_validation_2fo-fc_map_coef.cif.gz Display(976.75 KB)
5r8t_validation_2fo-fc_map_coef.cif
fo-fc (PDBx/mmCIF)5r8t_validation_fo-fc_map_coef.cif.gz Display(899.95 KB)
5r8t_validation_fo-fc_map_coef.cif
2fo-fc (MTZ)5r8t_validation_2fo-fc_map_coef.mtz Visualize(1.53 MB)
fo-fc (MTZ)5r8t_validation_fo-fc_map_coef.mtz Visualize(1.53 MB)

221716

PDB entries from 2024-06-26

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