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Ligand · TWK

TWK · 4-amino-6-(2,3-difluorophenyl)-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

TWK, 4-amino-6-(2,3-difluorophenyl)-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (C14 H9 F2 N5, 285.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
TWK
Formula
C14 H9 F2 N5
Class
ligand
Structures
2
PDB entries
1

Binding sites

TWK in 2 structures; the first of them:

  • 7BJO · Crystal structure of CHK1-10pt-mutant complex with compound 13 · TWK A301 · binds LEU15, GLY16, GLU17, ALA19, VAL23, ALA36, ILE68, MET84 and 8 more
  • 7BJO · Crystal structure of CHK1-10PT-mutant complex with compound 13 · TWK A301 · binds LEU15, GLY16, GLU17, ALA19, VAL23, ALA36, ILE68, MET84 and 8 more

Residues it binds most

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

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