Ligand · YMS
YMS · (1R,2S)-1-hydroxy-2-((S)-4-methyl-2-(((((1r,4S)-4-phenylcyclohexyl)oxy)carbonyl)amino)pentanamido)-3-((S)-2-oxopyrrolidin-3-yl)propane-1-sulfonic acid
YMS, (1R,2S)-1-hydroxy-2-((S)-4-methyl-2-(((((1r,4S)-4-phenylcyclohexyl)oxy)carbonyl)amino)pentanamido)-3-((S)-2-oxopyrrolidin-3-yl)propane-1-sulfonic acid (C26 H39 N3 O8 S, 553.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2…
- Component
- YMS
- Formula
- C26 H39 N3 O8 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
YMS in 2 structures; the first of them:
- 7LZZ · Structure of SARS-CoV-2 3CL protease in complex with inhibitor 5c · YMS A401 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144, CYS145 and 12 more
- 7LZZ · Structure of SARS-cov-2 3CL protease in complex with inhibitor 5C · YMS A401 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144, CYS145 and 12 more
Residues it binds most
HIS 2, LEU 2, MET 2, ALA 2, ARG 2, ASN 2, ASP 2, CYS 2, GLN 2, GLU 2 (residue and the binding sites it lines).
Found with
- YMV · (1S,2S)-1-hydroxy-2-((S)-4-methyl-2-(((((1r,4S)-4-phenylcyclohexyl)oxy)carbonyl)amino)pentanamido)-3-((S)-2-oxopyrrolidin-3-yl)propane-1-sulfonic acid
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