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Ligand · A1H39

A1H39 · (1~{R},4~{S},5~{R},8~{S})-2,6-dioxabicyclo[3.2.1]octane-4,8-diol

A1H39, (1~{R},4~{S},5~{R},8~{S})-2,6-dioxabicyclo[3.2.1]octane-4,8-diol (C6 H10 O4, 146.1 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
A1H39
Formula
C6 H10 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1H39 in 1 structure; the first of them:

  • 8RZG · ZgGH129 from Zobellia galactanivorans soaked with the product of the reaction ADG… · A1H39 A700 · binds PRO346, HIS347, TRP382, TYR422, TRP455, ASP486, ILE487, GLU517 and 5 more

Residues it binds most

ASP 4, ILE 4, TRP 4, CYS 4, GLN 4, GLU 4, HIS 4, LYS 4, PRO 4, TYR 4 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • CL · Chloride ion
  • EDO · 1,2-ethanediol
  • PEG · Di(hydroxyethyl)ether
  • PGE · Triethylene glycol
  • TLA · L(+)-tartaric acid

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