GL1X · GenesisL1 explorer

Ligand · 0ET

0ET · [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3R)-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-4-[[3-oxidanylidene-3-[2-[(2R)-2-oxidanylundecyl]sulfanylethylamino]propyl]amino]butyl] hydrogen phosphate

0ET, [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3R)-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-4-[[3-oxidanylidene-3-[2-[(2R)-2-oxidanylundecyl]sulfanylethylamino]propyl]amino]but…

Component
0ET
Formula
C32 H58 N7 O17 P3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0ET in 2 structures; the first of them:

  • 4GAH · Human acyl-CoA thioesterases 4 in complex with undecan-2-one-CoA inhibitor · 0ET A301 · binds ASP161, ILE174, VAL175, MET176, THR177, ALA178, ASN179, ARG206 and 15 more
  • 4GAH · Human acyl-CoA thioesterases 4 in complex with undecan-2-one-CoA inhibitor · 0ET A301 · binds ASP161, ILE174, VAL175, MET176, THR177, ALA178, ASN179, ARG206 and 15 more

Residues it binds most

ILE 6, PRO 6, GLY 6, MET 6, LEU 4, ARG 4, ASN 4, LYS 4, ALA 6, HIS 4 (residue and the binding sites it lines).

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