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Ligand · K44

K44 · 5,6,7,8-tetrabromo-1-methyl-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole

K44, 5,6,7,8-tetrabromo-1-methyl-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole (C10 H7 Br4 N3, 488.8 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…

Component
K44
Formula
C10 H7 Br4 N3
Class
ligand
Structures
2
PDB entries
1

Binding sites

K44 in 2 structures; the first of them:

  • 1ZOH · Crystal structure of protein kinase CK2 in complex with TBB-derivatives inhibitors · K44 A501 · binds VAL45, GLY46, VAL53, ILE66, LYS68, VAL95, PHE113, GLU114 and 5 more
  • 1ZOH · Crystal structure of protein kinase CK2 in complex with tbb- derivatives inhibitors · K44 A501 · binds VAL45, GLY46, VAL53, ILE66, LYS68, VAL95, PHE113, GLU114 and 5 more

Residues it binds most

VAL 2, ILE 2, ASN 2, ASP 2, GLU 2, GLY 2, LYS 2, MET 2, PHE 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • CL · Chloride ion
  • EDO · 1,2-ethanediol

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