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Ligand · HXJ

HXJ · 2-[[(E,2S,3R)-2-(hexanoylamino)-3-oxidanyl-dec-4-enoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

HXJ, 2-[[(E,2S,3R)-2-(hexanoylamino)-3-oxidanyl-dec-4-enoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium (C21 H44 N2 O6 P +1, 451.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
HXJ
Formula
C21 H44 N2 O6 P +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

HXJ in 2 structures; the first of them:

  • 4TSY · Crystal structure of FraC with lipids · HXJ A201 · binds ARG53, SER54, ALA83, THR84, GLY85, VAL87, SER105, PRO107 and 7 more
  • 4TSY · Crystal structure of frac with lipids · HXJ A201 · binds ARG53, SER54, ALA83, THR84, GLY85, VAL87, SER105, PRO107 and 7 more

Residues it binds most

TYR 24, SER 22, GLY 16, TRP 16, ARG 16, PRO 22, VAL 16, ASN 14, THR 14, ALA 10 (residue and the binding sites it lines).

Found with

  • HTO · Heptane-1,2,3-triol
  • SO4 · Sulfate ion

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