GL1X · GenesisL1 explorer

Ligand · VGG

VGG · 1-tert-butyl-3-(3-methylbenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

VGG, 1-tert-butyl-3-(3-methylbenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (C17 H21 N5, 295.4 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…

Component
VGG
Formula
C17 H21 N5
Class
ligand
Structures
4
PDB entries
2

Binding sites

VGG in 4 structures; the first of them:

  • 2WEI · Crystal structure of the kinase domain of Cryptosporidium parvum calcium dependent… · VGG A600 · binds LEU82, GLY83, LYS84, GLY85, VAL90, ALA103, VAL104, LYS105 and 10 more
  • 4LGG · Structure of 3MB-PP1 bound to analog-sensitive Src kinase · VGG A601 · binds LEU273, GLY274, VAL281, ALA293, ILE294, LYS295, GLU310, MET314 and 10 more
  • 2WEI · Crystal structure of the kinase domain of cryptosporidium parvum calcium dependent… · VGG A600 · binds LEU82, GLY83, LYS84, GLY85, VAL90, ALA103, VAL104, LYS105 and 10 more
  • 4LGG · Structure of 3MB-PP1 bound to analog-sensitive src kinase · VGG A601 · binds LEU273, GLY274, VAL281, ALA293, ILE294, LYS295, GLU310, MET314 and 10 more

Residues it binds most

LEU 6, VAL 6, GLY 6, ILE 6, MET 6, GLU 6, LYS 6, ALA 6, TYR 6, SER 4 (residue and the binding sites it lines).

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