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5SMM

PanDDA analysis group deposition of SARS-CoV-2 main protease ligands identified from single sequence-guideddeep generative framework -- Crystal structure of SARS-CoV-2 main protease in complex with Z1633315555 (Mpro-IBM0058)

Resources
File formatFile name (file size)
PDBx/mmCIF5smm.cif.gz Display(79.50 KB)
5smm.cif
PDBx/mmJSONall5smm.json.gz Display (Tree)(55.88 KB)
5smm.json
no-atom5smm-noatom.json.gz Display (Header)(14.48 KB)
5smm-noatom.json
add only5smm-plus.json.gz Display(866.00 B)
5smm-plus.json
PDBMLall5smm.xml.gz Display(106.50 KB)
5smm.xml
no-atom5smm-noatom.xml.gz Display(26.90 KB)
5smm-noatom.xml
ext-atom5smm-extatom.xml.gz Display(59.47 KB)
5smm-extatom.xml
pdb_nextgenallpdb_00005smm_xyz-enrich.cif.gz Display(87.11 KB)
pdb_00005smm_xyz-enrich.cif
no-atompdb_00005smm_xyz-no-atom-enrich.xml.gz Display(33.46 KB)
pdb_00005smm_xyz-no-atom-enrich.xml
ng-only5smm-plus.json.gz Display(2.86 KB)
5smm-plus.json
PDBpdb5smm.ent.gz Display(58.67 KB)
pdb5smm.ent
RDF5smm.rdf.gz Visualize(77.13 KB)
5smm.rdf
Structure factorsr5smmsf.ent.gz Display(1.44 MB)
r5smmsf.ent
Biological unit (mmCIF format)5smm-assembly1.cif.gz Display(131.65 KB)
5smm-assembly1.cif (A)

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

Biological unit (PDB format)5smm.pdb1.gz Display(104.75 KB)
5smm.pdb1 (A)

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

Validation reportsPDF5smm_validation.pdf.gz Display(743.84 KB)
5smm_validation.pdf
PDF-full5smm_full_validation.pdf.gz Display(748.09 KB)
5smm_full_validation.pdf
mmCIF5smm_validation.cif.gz Display(23.55 KB)
5smm_validation.cif
XML5smm_validation.xml.gz Display(16.09 KB)
5smm_validation.xml
PNG5smm_multipercentile_validation.png.gz Display(170.27 KB)
5smm_multipercentile_validation.png
SVG5smm_multipercentile_validation.svg.gz Display(975.00 B)
5smm_multipercentile_validation.svg
EDMap2fo-fc (PDBx/mmCIF)5smm_validation_2fo-fc_map_coef.cif.gz Display(354.93 KB)
5smm_validation_2fo-fc_map_coef.cif
fo-fc (PDBx/mmCIF)5smm_validation_fo-fc_map_coef.cif.gz Display(348.16 KB)
5smm_validation_fo-fc_map_coef.cif
2fo-fc (MTZ)5smm_validation_2fo-fc_map_coef.mtz Visualize(830.21 KB)
fo-fc (MTZ)5smm_validation_fo-fc_map_coef.mtz Visualize(830.21 KB)

250359

PDB entries from 2026-03-11

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