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Ligand · XX9

XX9 · N-benzyl-N-(3-tert-butyl-4-hydroxyphenyl)-2,6-dichloro-4-(dimethylamino)benzamide

XX9, N-benzyl-N-(3-tert-butyl-4-hydroxyphenyl)-2,6-dichloro-4-(dimethylamino)benzamide (C26 H28 Cl2 N2 O2, 471.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
XX9
Formula
C26 H28 Cl2 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

XX9 in 2 structures; the first of them:

  • 4OIV · Structural basis for small molecule NDB as a selective antagonist of FXR · XX9 A501 · binds LEU291, THR292, MET294, ALA295, THR296, HIS298, VAL299, MET332 and 15 more
  • 4OIV · Structural basis for small molecule ndb as a selective antagonist of fxr · XX9 A501 · binds LEU291, THR292, MET294, ALA295, THR296, HIS298, VAL299, MET332 and 15 more

Residues it binds most

MET 4, ILE 4, LEU 4, ALA 4, HIS 4, THR 4, TYR 4, PHE 4, ARG 4, SER 4 (residue and the binding sites it lines).

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