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Ligand · K0B

K0B · ~{N}-[[4,5-bis(fluoranyl)-1~{H}-benzimidazol-2-yl]methyl]-2-morpholin-4-yl-9-naphthalen-2-yl-purin-6-amine

K0B, ~{N}-[[4,5-bis(fluoranyl)-1~{H}-benzimidazol-2-yl]methyl]-2-morpholin-4-yl-9-naphthalen-2-yl-purin-6-amine (C27 H22 F2 N8 O, 512.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
K0B
Formula
C27 H22 F2 N8 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

K0B in 2 structures; the first of them:

  • 6RCH · Crystal structure of Casein kinase I isoform delta (CK1 delta) complexed with SR4133… · K0B A310 · binds ARG13, ILE15, GLY16, SER17, ILE23, LEU25, ALA36, LYS38 and 14 more
  • 6RCH · Crystal structure of casein kinase I isoform delta (CK1 delta) complexed with SR4133… · K0B A310 · binds ARG13, ILE15, GLY16, SER17, ILE23, LEU25, ALA36, LYS38 and 12 more

Residues it binds most

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

Found with

  • NA · Sodium ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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