Ligand · A1AGK
A1AGK · (1R,2S)-2-{[N-({[(2S)-1-(2-cyclohexylethyl)-5-oxopyrrolidin-2-yl]methoxy}carbonyl)-L-leucyl]amino}-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid
A1AGK, (1R,2S)-2-{[N-({[(2S)-1-(2-cyclohexylethyl)-5-oxopyrrolidin-2-yl]methoxy}carbonyl)-L-leucyl]amino}-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid (C27 H46 N4 O9 S, 602.7 g/mol), in the MolNFT structures on GenesisL1…
- Component
- A1AGK
- Formula
- C27 H46 N4 O9 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 2
Binding sites
A1AGK in 2 structures; the first of them:
- 9AT3 · Crystal structure of SARS-CoV-2 3CL protease in complex with an ethylcyclohexyl… · A1AGK A401 · binds HIS41, MET49, PHE140, LEU141, ASN142, SER144, CYS145, HIS163 and 11 more
- 9ATD · Crystal structure of MERS 3CL protease in complex with a ethylcyclohexyl 2-pyrrolidone… · A1AGK A402 · binds HIS41, LEU49, TYR54, PHE143, LEU144, CYS145, SER147, CYS148 and 12 more
Residues it binds most
HIS 3, LEU 3, MET 3, CYS 3, GLN 3, ALA 3, ASP 3, GLU 3, PHE 3, SER 3 (residue and the binding sites it lines).
Found with
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