GL1X · GenesisL1 explorer

Ligand · JPD

JPD · methyl (1S,3S,4R)-4-hydroxy-3-[(1S)-1-hydroxypropyl]-2-azabicyclo[2.2.2]octane-2-carboxylate

JPD, methyl (1S,3S,4R)-4-hydroxy-3-[(1S)-1-hydroxypropyl]-2-azabicyclo[2.2.2]octane-2-carboxylate (C12 H21 N O4, 243.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
JPD
Formula
C12 H21 N O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

JPD in 2 structures; the first of them:

  • 5QG4 · PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with… · JPD A401 · binds SER146, ASP148, VAL155, GLN157, GLU170, LEU172
  • 5QG4 · Pandda analysis group deposition -- crystal structure of PTP1B in complex with… · JPD A401 · binds SER146, ASP148, VAL155, GLN157

Residues it binds most

ASP 2, GLN 2, SER 2, VAL 2, GLU 1, LEU 1 (residue and the binding sites it lines).

Found with

  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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