Ligand · KJB
KJB · 3,3,3-tris(fluoranyl)-1-[4-[(1~{R})-1-[2-[[(2~{S})-5-(5-propan-2-yloxypyrimidin-4-yl)-2,3-dihydro-1~{H}-benzimidazol-2-yl]amino]pyridin-4-yl]ethyl]piperazin-1-yl]propan-1-one
KJB, 3,3,3-tris(fluoranyl)-1-[4-[(1~{R})-1-[2-[[(2~{S})-5-(5-propan-2-yloxypyrimidin-4-yl)-2,3-dihydro-1~{H}-benzimidazol-2-yl]amino]pyridin-4-yl]ethyl]piperazin-1-yl]propan-1-one (C28 H33 F3 N8 O2, 570.6 g/mol), in the MolNFT structures…
- Component
- KJB
- Formula
- C28 H33 F3 N8 O2
- Class
- ligand
- Structures
- 1
- PDB entries
- 1
Binding sites
KJB in 1 structure; the first of them:
- 6RSU · TBK1 in complex with inhibitor compound 35 · KJB A701 · binds ASP13, ILE14, LEU15, GLY16, VAL23, ARG25, ALA36, LYS38 and 9 more
Residues it binds most
ASP 1, GLY 1, MET 1, ALA 1, ARG 1, CYS 1, GLU 1, ILE 1, LEU 1, LYS 1 (residue and the binding sites it lines).
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