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Ligand · FU9

FU9 · 3-(cyclopropylamino)-5-{[3-(trifluoromethyl)phenyl]amino}pyrimido[4,5-c]quinoline-8-carboxylic acid

FU9, 3-(cyclopropylamino)-5-{[3-(trifluoromethyl)phenyl]amino}pyrimido[4,5-c]quinoline-8-carboxylic acid (C22 H16 F3 N5 O2, 439.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
FU9
Formula
C22 H16 F3 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

FU9 in 2 structures; the first of them:

  • 3R0T · Crystal structure of human protein kinase CK2 alpha subunit in complex with the inhibitor… · FU9 A338 · binds LEU45, GLY46, ARG47, GLY48, VAL53, GLU55, VAL66, LYS68 and 11 more
  • 3R0T · Crystal structure of human protein kinase CK2 alpha subunit in complex with the inhibitor… · FU9 A338 · binds LEU45, GLY46, ARG47, GLY48, VAL53, GLU55, VAL66, LYS68 and 11 more

Residues it binds most

VAL 2, GLU 2, GLY 2, HIS 2, ILE 2, ARG 2, ASN 2, ASP 2, LEU 2, LYS 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • PEG · Di(hydroxyethyl)ether

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