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Ligand · TJ1

TJ1 · 3-(propan-2-yl)-1,2,4-oxadiazol-5(4H)-one

TJ1, 3-(propan-2-yl)-1,2,4-oxadiazol-5(4H)-one (C5 H8 N2 O2, 128.1 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 and the…

Component
TJ1
Formula
C5 H8 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

TJ1 in 2 structures; the first of them:

  • 5QY2 · PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment F2X-Entry A12b · TJ1 B401 · binds PRO5, THR7, TYR68, GLN70, GLU83, LYS88, PHE89, ILE92
  • 5QY2 · Pandda analysis group deposition -- AAR2/RNASEH in complex with fragment F2X-entry A12B · TJ1 B401 · binds PRO5, THR7, TYR68, GLN70, GLU83, PHE89, ILE92

Residues it binds most

GLN 2, GLU 2, ILE 2, PHE 2, PRO 2, THR 2, TYR 2, LYS 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • PGR · R-1,2-propanediol

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