Ligand · 46C
46C · 4-[(6-chloro-1-oxo-4-phenyl-3-propanoylisoquinolin-2(1H)-yl)methyl]benzoic acid
46C, 4-[(6-chloro-1-oxo-4-phenyl-3-propanoylisoquinolin-2(1H)-yl)methyl]benzoic acid (C26 H20 Cl N O4, 445.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…
- Component
- 46C
- Formula
- C26 H20 Cl N O4
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
46C in 2 structures; the first of them:
- 2ZDT · Crystal Structure of human JNK3 complexed with an isoquinolone inhibitor · 46C A901 · binds LYS68, ILE70, GLY71, SER72, GLY73, VAL78, ALA91, LYS93 and 12 more
- 2ZDT · Crystal structure of human JNK3 complexed with an isoquinolone inhibitor · 46C A901 · binds LYS68, ILE70, GLY71, SER72, GLY73, VAL78, ALA91, LYS93 and 12 more
Residues it binds most
ALA 2, GLY 2, ILE 2, LEU 2, LYS 2, MET 2, SER 2, VAL 2, ASN 2, ASP 2 (residue and the binding sites it lines).
Found with
- GOL · Glycerol
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