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Ligand · VSB

VSB · 7-[cis-4-(4-methylpiperazin-1-yl)cyclohexyl]-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

VSB, 7-[cis-4-(4-methylpiperazin-1-yl)cyclohexyl]-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine (C29 H34 N6 O, 482.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
VSB
Formula
C29 H34 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

VSB in 2 structures; the first of them:

  • 3VS2 · Crystal structure of HCK complexed with a pyrrolo-pyrimidine inhibitor… · VSB A601 · binds LEU273, GLY274, ALA275, VAL281, ALA293, LYS295, MET314, VAL323 and 13 more
  • 3VS2 · Crystal structure of hck complexed with a pyrrolo-pyrimidine inhibitor… · VSB A601 · binds LEU273, GLY274, ALA275, VAL281, ALA293, LYS295, MET314, VAL323 and 13 more

Residues it binds most

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

Found with

  • CA · Calcium ion
  • CL · Chloride ion

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