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Ligand · Q68

Q68 · ~{N}-[[1-[[(1~{S},2~{R},3~{R},4~{S},6~{S})-6-(hexylamino)-2,3,4-tris(oxidanyl)cyclohexyl]methyl]-1,2,3-triazol-4-yl]methyl]ethanamide

Q68, ~{N}-[[1-[[(1~{S},2~{R},3~{R},4~{S},6~{S})-6-(hexylamino)-2,3,4-tris(oxidanyl)cyclohexyl]methyl]-1,2,3-triazol-4-yl]methyl]ethanamide (C18 H33 N5 O4, 383.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
Q68
Formula
C18 H33 N5 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

Q68 in 1 structure; the first of them:

  • 6Z3I · Structure of recombinant beta-glucocerebrosidase in complex with bifunctional… · Q68 BBB520 · binds ASP127, PHE128, TRP179, ASN234, GLU235, TYR244, PRO245, PHE246 and 10 more

Residues it binds most

ASN 1, GLU 1, PHE 1, TRP 1, TYR 1, ASP 1, CYS 1, GLN 1, HIS 1, LEU 1 (residue and the binding sites it lines).

Found with

  • BMA · beta-D-mannopyranose
  • MAN · alpha-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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