U.S. Department of Health and Human Services — National Institutes of Health

PanDDA analysis group deposition -- Crystal Structure of COVID-19 main protease in complex with Z44592329

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Created on Sat, 2020-03-21 14:45, last updated on Tue, 2020-04-28 18:09

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General Information

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

Model ID

3DPX-013182

Category

Proteins, Macromolecules and Viruses

Keyword(s)

SARS-CoV-2, COVID-19, SGC - Diamond I04-1 fragment screening, PanDDA, XChemExplorer, HYDROLASE-HYDROLASE INHIBITOR complex

Protein Data Bank ID

PanDDA analysis group deposition -- Crystal Structure of COVID-19 main protease in complex with Z44592329

Experimental Method

X-RAY DIFFRACTION

Resolution

1.580

Model Details

Associated Species

Escherichia coli

Oligomeric Details

dimeric

R-Factor

0.2342

Scattering Type

x-ray

Attribution

Citation Title

PanDDA analysis of COVID-19 main protease against the DSI-poised Fragment Library

STL/VRML Files

PDB-5R83-ribbon-secondary.wrl

PDB-5R83-ribbon-rainbow.wrl

PDB-5R83-ribbon-bychain.wrl

PDB-5R83-ribbon.stl

PDB-5R83-surf-bychain.wrl

PDB-5R83-surf-hydropathy.wrl

PDB-5R83-surf-coulombic.wrl

PDB-5R83-surf.stl

X3D Files

PDB-5R83-ribbon-secondary.x3d

PDB-5R83-ribbon-rainbow.x3d

PDB-5R83-ribbon-bychain.x3d

PDB-5R83-ribbon.x3d

PDB-5R83-surf-bychain.x3d

PDB-5R83-surf-hydropathy.x3d

PDB-5R83-surf-coulombic.x3d

PDB-5R83-surf.x3d

PDB-5R83-ribbon-secondary.x3d

PDB-5R83-ribbon-rainbow.x3d

PDB-5R83-ribbon-bychain.x3d

PDB-5R83-ribbon.x3d

PDB-5R83-surf-bychain.x3d

PDB-5R83-surf-hydropathy.x3d

PDB-5R83-surf-coulombic.x3d

PDB-5R83-surf.x3d

QR Code for https://3dprint.nih.gov/discover/3dpx-013182

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