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Ligand · 3EL

3EL · N-{4-[(3-{2-[(trans-4-aminocyclohexyl)amino]pyrimidin-4-yl}pyridin-2-yl)oxy]naphthalen-1-yl}benzenesulfonamide

3EL, N-{4-[(3-{2-[(trans-4-aminocyclohexyl)amino]pyrimidin-4-yl}pyridin-2-yl)oxy]naphthalen-1-yl}benzenesulfonamide (C31 H30 N6 O3 S, 566.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
3EL
Formula
C31 H30 N6 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

3EL in 2 structures; the first of them:

  • 4U79 · Crystal structure of human JNK3 in complex with a benzenesulfonamide inhibitor. · 3EL A501 · binds ILE70, VAL78, ALA91, LYS93, LEU95, ARG107, GLU111, MET115 and 15 more
  • 4U79 · Crystal structure of human JNK3 in complex with a benzenesulfonamide inhibitor. · 3EL A501 · binds ILE70, VAL78, ALA91, LYS93, LEU95, ARG107, GLU111, MET115 and 15 more

Residues it binds most

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

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