PanDDA analysis group deposition SARS-CoV-2 main protease fragment screen -- Crystal Structure of SARS-CoV-2 main protease in complex with Z4439011584 (Mpro-x2705)

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cruzp2

Created on Mon, 2020-06-01 12:49, last updated on Tue, 2020-07-14 17:28

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General Information

This Model was autogenerated from the "Quick Submit" tool.

Model ID 

3DPX-014477

Category 

Proteins, Macromolecules and Viruses

Keyword(s) 

SGC - Diamond I04-1 fragment screening, PanDDA, XChemExplorer, HYDROLASE-HYDROLASE INHIBITOR complex

Protein Data Bank ID 

5RH7

 SARS-CoV-2, COVID-19

Experimental Method 

X-RAY DIFFRACTION

Resolution 

1.710

Model Details

Associated Species 

Escherichia coli

Oligomeric Details 

dimeric

R-Factor 

0.1868

Scattering Type 

x-ray

Attribution

Citation Title 

PanDDA analysis group deposition SARS-CoV-2 main protease fragment screen

STL/VRML Files

 

PDB-5RH7-ribbon-secondary.wrl

PDB-5RH7-ribbon-rainbow.wrl

PDB-5RH7-ribbon-bychain.wrl

PDB-5RH7-ribbon.stl

PDB-5RH7-surf-bychain.wrl

PDB-5RH7-surf-hydropathy.wrl

PDB-5RH7-surf-coulombic.wrl

PDB-5RH7-surf.stl

PDB-5RH7.zip

X3D Files

 

PDB-5RH7-ribbon-secondary.x3d

PDB-5RH7-ribbon-rainbow.x3d

PDB-5RH7-ribbon-bychain.x3d

PDB-5RH7-ribbon.x3d

PDB-5RH7-surf-bychain.x3d

PDB-5RH7-surf-hydropathy.x3d

PDB-5RH7-surf-coulombic.x3d

PDB-5RH7-surf.x3d

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