Deposited model

PDB 7AEG|dpdb_rd3k17t0

Deposited model

SARS-CoV-2 main protease in a covalent complex with SDZ 224015 derivative, compound 5

Program
REFMAC 5.8.0267
Model type
Deposited
Purpose
Reference
Authors
Owen, C.D., Redhead, M.A., Lukacik, P., Strain-Damerell, C., Fearon, D., Brewitz, L., Collette, A., Robinson, C., Collins, P., Radoux, C., Navratilova, I., Douangamath, A., von Delft, F., Malla, T.R., Nugen, T., Hull, H., Tumber, A., Schofield, C.J., Hallet, D., Stuart, D.I., Hopkins, A.L., Walsh, M.A.
Atoms
2,721
Residues
310
Protein chains
2
Unmodeled fraction
0%

Evaluations

R-work
0.164
R-free
0.202
Clashscore
3.0

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
3C-like proteinase305
  • Severe acute respiratory syndrome coronavirus 22697049
—
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
N-[(benzyloxy)carbonyl]-L-valyl-N-[(1S)-1-(carboxymethyl)-3-fluoro-2-oxopropyl]-L-alaninamide5——

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations