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Ligand · RXB

RXB · (1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin-5-yl)amino]ethyl acetate

RXB, (1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin-5-yl)amino]ethyl acetate (C19 H14 N2 O6, 366.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
RXB
Formula
C19 H14 N2 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

RXB in 2 structures; the first of them:

  • 3DEI · Crystal Structures of Caspase-3 with Bound Isoquinoline-1,3,4-trione Derivative Inhibitors · RXB C300 · binds OCS163, THR166, LEU168, TYR204, THR255, PHE256, THR166, GLU167 and 4 more
  • 3DEI · Crystal structures of caspase-3 with bound isoquinoline-1,3,4-trione derivative inhibitors · RXB C300 · binds OCS163, THR166, LEU168, TYR204, THR255, PHE256, THR166, GLU167 and 4 more

Residues it binds most

THR 2, LEU 2, PHE 2, TYR 2, GLU 2, OCS 2 (residue and the binding sites it lines).

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