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Ligand · IA9

IA9 · 2-chloro-4-fluoro-3-methyl-N-[2-(4-methylpiperazin-1-yl)-5-nitrophenyl]benzamide

IA9, 2-chloro-4-fluoro-3-methyl-N-[2-(4-methylpiperazin-1-yl)-5-nitrophenyl]benzamide (C19 H20 Cl F N4 O3, 406.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
IA9
Formula
C19 H20 Cl F N4 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

IA9 in 2 structures; the first of them:

  • 4IA9 · Crystal structure of human WD REPEAT DOMAIN 5 in complex with… · IA9 A401 · binds ALA47, VAL48, SER49, SER50, SER64, ALA65, GLY89, ILE90 and 11 more
  • 4IA9 · Crystal structure of human wd repeat domain 5 in complex with 2… · IA9 A401 · binds ALA47, VAL48, SER49, SER50, SER64, ALA65, GLY89, ILE90 and 11 more

Residues it binds most

SER 2, ALA 2, ASP 2, ILE 2, PHE 2, CYS 2, GLY 2, LEU 2, PRO 2, TYR 2 (residue and the binding sites it lines).

Found with

  • UNX · Unknown atom or ion
  • EDO · 1,2-ethanediol

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