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Ligand · W9S

W9S · (1S,2S,3R,4S,5S)-5-amino-1-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol

W9S, (1S,2S,3R,4S,5S)-5-amino-1-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol (C7 H15 N O5, 193.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
W9S
Formula
C7 H15 N O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

W9S in 2 structures; the first of them:

  • 7K9Q · Co-crystal structure of alpha glucosidase with compound 4 · W9S A1001 · binds TRP423, ASP451, ILE452, ILE488, TRP525, TRP562, ASP564, MET565 and 6 more
  • 7K9Q · Co-crystal structure of alpha glucosidase with compound 4 · W9S A1001 · binds TRP423, ASP451, ILE452, ILE488, TRP525, TRP562, ASP564, MET565 and 6 more

Residues it binds most

TRP 4, ASP 4, ARG 4, ILE 4, HIS 4, MET 4, PHE 4 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • PEG · Di(hydroxyethyl)ether
  • PG4 · Tetraethylene glycol
  • PGE · Triethylene glycol

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