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4FCQ

Targeting conserved water molecules: Design of 4-aryl-5-cyanopyrrolo[2,3-d]pyrimidine Hsp90 inhibitors using fragment-based screening and structure-based optimization

Resources
File formatFile name (file size)
PDBx/mmCIF4fcq.cif.gz Display(58.50 KB)
4fcq.cif
PDBx/mmJSONall4fcq.json.gz Display (Tree)(41.96 KB)
4fcq.json
no-atom4fcq-noatom.json.gz Display (Header)(12.01 KB)
4fcq-noatom.json
add only4fcq-plus.json.gz Display(1.24 KB)
4fcq-plus.json
PDBMLall4fcq.xml.gz Display(78.07 KB)
4fcq.xml
no-atom4fcq-noatom.xml.gz Display(23.62 KB)
4fcq-noatom.xml
ext-atom4fcq-extatom.xml.gz Display(40.11 KB)
4fcq-extatom.xml
PDBpdb4fcq.ent.gz Display(42.27 KB)
pdb4fcq.ent
RDF4fcq.rdf.gz Visualize(68.32 KB)
4fcq.rdf
Structure factorsr4fcqsf.ent.gz Display(209.29 KB)
r4fcqsf.ent
Biological unit (mmCIF format)4fcq-assembly1.cif.gz Display(47.73 KB)
4fcq-assembly1.cif (A)

*author defined assembly, 1 molecule(s) (monomeric)

4fcq-assembly2.cif.gz Display(90.35 KB)
4fcq-assembly2.cif (A)

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

Biological unit (PDB format)4fcq.pdb1.gz Display(36.89 KB)
4fcq.pdb1 (A)

*author defined assembly, 1 molecule(s) (monomeric)

4fcq.pdb2.gz Display(72.00 KB)
4fcq.pdb2 (A)

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

Validation reportsPDF4fcq_validation.pdf.gz Display(776.63 KB)
4fcq_validation.pdf
PDF-full4fcq_full_validation.pdf.gz Display(779.65 KB)
4fcq_full_validation.pdf
mmCIF4fcq_validation.cif.gz Display(16.91 KB)
4fcq_validation.cif
XML4fcq_validation.xml.gz Display(12.31 KB)
4fcq_validation.xml
PNG4fcq_multipercentile_validation.png.gz Display(168.90 KB)
4fcq_multipercentile_validation.png
SVG4fcq_multipercentile_validation.svg.gz Display(974.00 B)
4fcq_multipercentile_validation.svg
EDMap2fo-fc (PDBx/mmCIF)4fcq_validation_2fo-fc_map_coef.cif.gz Display(154.73 KB)
4fcq_validation_2fo-fc_map_coef.cif
fo-fc (PDBx/mmCIF)4fcq_validation_fo-fc_map_coef.cif.gz Display(141.97 KB)
4fcq_validation_fo-fc_map_coef.cif
2fo-fc (MTZ)4fcq_validation_2fo-fc_map_coef.mtz Visualize(373.87 KB)
fo-fc (MTZ)4fcq_validation_fo-fc_map_coef.mtz Visualize(373.87 KB)

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PDB entries from 2024-07-17

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