Ligand · GWS
GWS · 2-cyclohexyl-~{N}-pyridin-3-yl-ethanamide
GWS, 2-cyclohexyl-~{N}-pyridin-3-yl-ethanamide (C13 H18 N2 O, 218.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…
- Component
- GWS
- Formula
- C13 H18 N2 O
- Class
- ligand
- Structures
- 4
- PDB entries
- 3
Binding sites
GWS in 4 structures; the first of them:
- 5R84 · PanDDA analysis group deposition -- Crystal Structure of COVID-19 main protease in… · GWS A1001 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144, CYS145 and 8 more
- 5QIF · Pandda analysis group deposition of models with modelled events (E.G. bound ligands)… · GWS A402 · binds ARG226, THR229, SER230
- 5R84 · Pandda analysis group deposition -- crystal structure of COVID-19 main protease in… · GWS A1001 · binds HIS41, MET49, PHE140, LEU141, ASN142, CYS145, HIS163, HIS164 and 5 more
- 7QT5 · Room temperature in-situ SARS-cov-2 mpro with bound Z31792168 · GWS A401 · binds HIS41, MET49, PHE140, LEU141, ASN142, SER144, CYS145, HIS163 and 4 more
Residues it binds most
HIS 3, MET 3, ARG 3, ASN 3, CYS 3, GLN 3, GLU 3, LEU 3, PHE 3, SER 3 (residue and the binding sites it lines).
Found with
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