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Ligand · B6A

B6A · [2-amino-1-(piperidin-4-ylmethyl)-1H-benzimidazol-6-yl](phenyl)methanone

B6A, [2-amino-1-(piperidin-4-ylmethyl)-1H-benzimidazol-6-yl](phenyl)methanone (C20 H22 N4 O, 334.4 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
B6A
Formula
C20 H22 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

B6A in 2 structures; the first of them:

  • 3UPX · Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with… · B6A A1 · binds LEU57, GLY58, VAL65, ALA78, LYS80, MET112, LEU126, GLY128 and 8 more
  • 3UPX · Calcium-dependent protein kinase 1 from toxoplasma gondii (TGCDPK1) in complex with… · B6A A1 · binds LEU57, GLY58, VAL65, ALA78, LYS80, MET112, LEU126, GLY128 and 8 more

Residues it binds most

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

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