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Ligand · 9IK

9IK · ~{N}-(4-phenoxyphenyl)-7~{H}-pyrrolo[2,3-d]pyrimidin-4-amine

9IK, ~{N}-(4-phenoxyphenyl)-7~{H}-pyrrolo[2,3-d]pyrimidin-4-amine (C18 H14 N4 O, 302.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
9IK
Formula
C18 H14 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

9IK in 2 structures; the first of them:

  • 7Q8Z · Crystal structure of TTBK2 in complex with VNG1.33 (compound 27) · 9IK A303 · binds ILE27, GLY28, ILE35, ALA48, LYS50, CYS78, MET94, GLN95 and 8 more
  • 7Q8Z · Crystal structure of TTBK2 in complex with VNG1.33 (compound 27) · 9IK A303 · binds ILE27, ILE35, ALA48, LYS50, CYS78, MET94, GLN95, LEU96 and 6 more

Residues it binds most

GLN 4, ILE 4, LEU 4, ALA 4, ASN 4, ASP 4, CYS 4, LYS 4, MET 4, SER 4 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion

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