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Ligand · 3OA

3OA · 1,4-dihydroxy-5,8-bis{[2-(2-hydroxyethoxy)ethyl]amino}anthracene-9,10-dione

3OA, 1,4-dihydroxy-5,8-bis{[2-(2-hydroxyethoxy)ethyl]amino}anthracene-9,10-dione (C22 H26 N2 O8, 446.4 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…

Component
3OA
Formula
C22 H26 N2 O8
Class
ligand
Structures
2
PDB entries
1

Binding sites

3OA in 2 structures; the first of them:

  • 4RC3 · Crystal structure of Ser/Thr kinase Pim1 in complex with Mitoxantrone derivatives · 3OA A401 · binds LEU44, GLY45, SER46, PHE49, VAL52, ALA65, ILE104, LEU120 and 10 more
  • 4RC3 · Crystal structure of SER/THR kinase PIM1 in complex with mitoxantrone derivatives · 3OA A401 · binds LEU44, GLY45, SER46, PHE49, VAL52, ALA65, ILE104, LEU120 and 10 more

Residues it binds most

LEU 2, ASP 2, GLU 2, ILE 2, VAL 2, ALA 2, ARG 2, GLN 2, GLY 2, PHE 2 (residue and the binding sites it lines).

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