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Ligand · 45Q

45Q · N-[3-(4-amino-3-methylphenyl)-1H-pyrazol-5-yl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide

45Q, N-[3-(4-amino-3-methylphenyl)-1H-pyrazol-5-yl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide (C23 H28 N6 O, 404.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
45Q
Formula
C23 H28 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

45Q in 2 structures; the first of them:

  • 5IUI · Crystal Structure of Anaplastic Lyphoma Kinase (ALK) in complex with 4 · 45Q A1501 · binds LEU1122, GLY1123, PHE1127, VAL1130, ALA1148, LYS1150, GLU1167, VAL1180 and 10 more
  • 5IUI · Crystal structure of anaplastic lyphoma kinase (ALK) in complex with 4 · 45Q A1501 · binds LEU1122, GLY1123, PHE1127, VAL1130, ALA1148, LYS1150, GLU1167, VAL1180 and 10 more

Residues it binds most

GLY 2, LEU 2, GLU 2, ALA 2, VAL 2, LYS 2, MET 2, PHE 2 (residue and the binding sites it lines).

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