GL1X · GenesisL1 explorer

Ligand · 4WS

4WS · N-{[(1R,2R,3R,7S,7aR)-1,2,7-trihydroxyhexahydro-1H-pyrrolizin-3-yl]methyl}acetamide

4WS, N-{[(1R,2R,3R,7S,7aR)-1,2,7-trihydroxyhexahydro-1H-pyrrolizin-3-yl]methyl}acetamide (C10 H18 N2 O4, 230.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
4WS
Formula
C10 H18 N2 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

4WS in 2 structures; the first of them:

  • 5BXT · LNBase in complex with LNB-NHAcAUS · 4WS A704 · binds HIS263, ASP320, GLU321, TRP373, TRP394, TYR419, TYR427, TRP465 and 1 more
  • 5BXT · Lnbase in complex with lnb-nhacaus · 4WS A704 · binds HIS263, ASP320, GLU321, TRP373, TRP394, TYR419, TYR427, TRP465 and 1 more

Residues it binds most

TRP 4, ASP 4, TYR 4, GLU 4, HIS 4 (residue and the binding sites it lines).

Found with

  • GAL · beta-D-galactopyranose
  • SO4 · Sulfate ion

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