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Ligand · QK2

QK2 · 7-fluoranyl-5-methyl-3-[1-(oxan-4-yl)piperidin-4-yl]-1~{H}-benzimidazol-2-one

QK2, 7-fluoranyl-5-methyl-3-[1-(oxan-4-yl)piperidin-4-yl]-1~{H}-benzimidazol-2-one (C18 H24 F N3 O2, 333.4 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…

Component
QK2
Formula
C18 H24 F N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

QK2 in 2 structures; the first of them:

  • 6ZG9 · Structure of M1-StaR-T4L in complex with GSK1034702 at 2.5A · QK2 A1201 · binds PHE77, SER78, LEU81, TYR82, TYR85, TRP91, ALA101, LEU102 and 10 more
  • 6ZG9 · Structure of M1-star-T4L in complex with GSK1034702 at 2.5A · QK2 A1201 · binds SER78, LEU81, TYR82, TYR85, TRP91, LEU102, ASP105, SER109 and 6 more

Residues it binds most

TYR 2, LEU 2, SER 2, TRP 2, ASP 2, CYS 2, ALA 1, ILE 1, PHE 1 (residue and the binding sites it lines).

Found with

  • OLA · Oleic acid
  • PO4 · Phosphate ion
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid

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