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Ligand · X11

X11 · 2-(4,6-diamino-1,3,5-triazin-2-yl)phenol

X11, 2-(4,6-diamino-1,3,5-triazin-2-yl)phenol (C9 H9 N5 O, 203.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
X11
Formula
C9 H9 N5 O
Class
ligand
Structures
4
PDB entries
2

Binding sites

X11 in 4 structures; the first of them:

  • 3QQJ · CDK2 in complex with inhibitor L2 · X11 A300 · binds ILE10, GLY11, VAL18, ALA31, VAL64, PHE80, GLU81, PHE82 and 7 more
  • 4QNA · MST3 IN COMPLEX WITH 2-(4,6-Diamino-1,3,5-triazin-2-yl)phenol · X11 A401 · binds ILE30, GLY31, VAL38, ALA51, THR83, MET99, GLU100, TYR101 and 4 more
  • 3QQJ · CDK2 in complex with inhibitor L2 · X11 A300 · binds ILE10, GLY11, VAL18, ALA31, VAL64, PHE80, GLU81, PHE82 and 7 more
  • 4QNA · MST3 in complex with 2-(4,6-diamino-1,3,5-triazin-2-YL)PHENOL · X11 A401 · binds ILE30, GLY31, VAL38, ALA51, THR83, MET99, GLU100, TYR101 and 4 more

Residues it binds most

ALA 4, LEU 4, VAL 4, ASP 4, GLU 4, GLY 4, ILE 4, PHE 2, GLN 2, HIS 2 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion
  • EDO · 1,2-ethanediol

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