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Ligand · 2IO

2IO · (3S,6S)-3,6-bis(2-methylpropyl)piperazine-2,5-dione

2IO, (3S,6S)-3,6-bis(2-methylpropyl)piperazine-2,5-dione (C12 H22 N2 O2, 226.3 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
2IO
Formula
C12 H22 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

2IO in 2 structures; the first of them:

  • 7OW9 · Crystal structure of a staphylococcal orthologue of CYP134A1 (CYPX) in complex with… · 2IO A801 · binds LEU62, ALA66, VAL74, ALA76, ILE163, ASN227, LEU230, ALA231 and 3 more
  • 7OW9 · Crystal structure of a staphylococcal orthologue of CYP134A1 (cypx) in complex with… · 2IO A801 · binds LEU62, ALA66, VAL74, ALA76, ILE163, ASN227, LEU230, ALA231 and 3 more

Residues it binds most

ALA 2, LEU 2, VAL 2, ASN 2, GLU 2, ILE 2, TYR 2 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • NO3 · Nitrate ion

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