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Ligand · TO4

TO4 · propan-2-yl (R)-dodec-11-en-1-ylphosphonofluoridate

TO4, propan-2-yl (R)-dodec-11-en-1-ylphosphonofluoridate (C15 H30 F O2 P, 292.4 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 it binds most…

Component
TO4
Formula
C15 H30 F O2 P
Class
ligand
Structures
2
PDB entries
1

Binding sites

TO4 in 2 structures; the first of them:

  • 4X91 · Crystal structure of Lysosomal Phospholipase A2 in complex with Isopropyl… · TO4 A405 · binds GLY12, ASP13, LEU14, TYR104, TRP130, HIS164, SER165, MET166 and 11 more
  • 4X91 · Crystal structure of lysosomal phospholipase A2 in complex with isopropyl… · TO4 A405 · binds GLY12, ASP13, LEU14, TYR104, TRP130, HIS164, SER165, MET166 and 11 more

Residues it binds most

LEU 8, THR 8, VAL 8, HIS 8, GLN 6, SER 8, ASP 8, GLY 8, MET 8, TRP 8 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • PO4 · Phosphate ion
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid
  • MPD · (4S)-2-methyl-2,4-pentanediol

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