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Ligand · A1D9E

A1D9E · [(2~{R})-2-oxidanyl-3-[oxidanyl-[(2~{S},3~{R},5~{R},6~{R})-2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]oxy-phosphoryl]oxy-propyl] hexadecanoate

A1D9E, [(2~{R})-2-oxidanyl-3-[oxidanyl-[(2~{S},3~{R},5~{R},6~{R})-2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]oxy-phosphoryl]oxy-propyl] hexadecanoate (C25 H49 O12 P, 572.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
A1D9E
Formula
C25 H49 O12 P
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1D9E in 1 structure; the first of them:

  • 8ZX4 · LPI-bound GPR55 in complex with G13 · A1D9E R301 · binds PHE12, ASN16, PHE102, TYR106, PHE110, LEU148, VAL149, GLY152 and 17 more

Residues it binds most

PHE 1, LEU 1, ASN 1, GLN 1, MET 1, SER 1, ARG 1, GLY 1, HIS 1, ILE 1 (residue and the binding sites it lines).

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