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Ligand · Q17

Q17 · 2-{4-[(3-aminopropyl)amino]quinazolin-2-yl}phenol

Q17, 2-{4-[(3-aminopropyl)amino]quinazolin-2-yl}phenol (C17 H18 N4 O, 294.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
Q17
Formula
C17 H18 N4 O
Class
ligand
Structures
4
PDB entries
2

Binding sites

Q17 in 4 structures; the first of them:

  • 3UIX · Crystal structure of Pim1 kinase in complex with small molecule inhibitor · Q17 A400 · binds LEU44, GLY45, PHE49, VAL52, ALA65, LYS67, GLU89, ILE104 and 9 more
  • 4LM5 · Crystal structure of Pim1 in complex with 2-{4-[(3-aminopropyl)amino]quinazolin-2-yl}pheno… · Q17 A401 · binds LEU44, GLY45, PHE49, VAL52, ALA65, LYS67, GLU89, ILE104 and 10 more
  • 3UIX · Crystal structure of PIM1 kinase in complex with small molecule inhibitor · Q17 A400 · binds LEU44, GLY45, PHE49, VAL52, ALA65, LYS67, GLU89, ILE104 and 9 more
  • 4LM5 · Crystal structure of PIM1 in complex with 2-{4-[(3-aminopropyl)… · Q17 A401 · binds LEU44, GLY45, PHE49, VAL52, ALA65, LYS67, GLU89, ILE104 and 10 more

Residues it binds most

GLU 4, LEU 4, ASP 4, ILE 4, VAL 4, ALA 4, ARG 4, GLY 4, LYS 4, PHE 4 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol
  • CA · Calcium ion
  • CL · Chloride ion
  • SO4 · Sulfate ion

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