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Ligand · WCX

WCX · 4-{5-[(1-methylpiperidin-4-yl)oxy]-1H-benzimidazol-1-yl}-2-{(1R)-1-[2-(trifluoromethyl)phenyl]ethoxy}benzamide

WCX, 4-{5-[(1-methylpiperidin-4-yl)oxy]-1H-benzimidazol-1-yl}-2-{(1R)-1-[2-(trifluoromethyl)phenyl]ethoxy}benzamide (C29 H29 F3 N4 O3, 538.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
WCX
Formula
C29 H29 F3 N4 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

WCX in 2 structures; the first of them:

  • 2XNP · Structure of Nek2 bound to CCT244858 · WCX A1280 · binds ILE14, GLY15, TYR19, CYS22, VAL35, LYS37, VAL68, MET86 and 13 more
  • 2XNP · Structure of NEK2 bound to CCT244858 · WCX A1280 · binds ILE14, GLY15, TYR19, CYS22, VAL35, LYS37, VAL68, MET86 and 13 more

Residues it binds most

GLY 2, ASP 2, CYS 2, GLU 2, PHE 2, TYR 2, VAL 2, ALA 2, ASN 2, ILE 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • EDO · 1,2-ethanediol

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