Ligand · XM2
XM2 · N-[(benzyloxy)carbonyl]-O-tert-butyl-L-threonyl-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-phenylalaninamide
XM2, N-[(benzyloxy)carbonyl]-O-tert-butyl-L-threonyl-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-phenylalaninamide (C32 H44 N4 O7, 596.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…
- Component
- XM2
- Formula
- C32 H44 N4 O7
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
XM2 in 2 structures; the first of them:
- 7JQ4 · Structure of the SARS-CoV-2 main protease in complex with inhibitor MPI7 · XM2 A401 · binds HIS41, CYS44, MET49, TYR54, PHE140, LEU141, ASN142, GLY143 and 15 more
- 7JQ4 · Structure of the SARS-cov-2 main protease in complex with inhibitor MPI7 · XM2 A401 · binds HIS41, CYS44, MET49, TYR54, PHE140, LEU141, ASN142, GLY143 and 15 more
Residues it binds most
HIS 2, CYS 2, GLN 2, LEU 2, MET 2, ALA 2, ARG 2, ASN 2, ASP 2, GLU 2 (residue and the binding sites it lines).
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