Ligand · XJ8
XJ8 · N-[(1S)-2-[(2-amino-5-quinolyl)methylamino]-1-benzyl-2-oxo-ethyl]-4-hydroxy-2-oxo-1H-quinoline-6-carboxamide
XJ8, N-[(1S)-2-[(2-amino-5-quinolyl)methylamino]-1-benzyl-2-oxo-ethyl]-4-hydroxy-2-oxo-1H-quinoline-6-carboxamide (C29 H25 N5 O4, 507.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…
- Component
- XJ8
- Formula
- C29 H25 N5 O4
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
XJ8 in 2 structures; the first of them:
- 4CRA · Creating novel F1 inhibitors through fragment based lead generation and structure aided… · XJ8 A1491 · binds ARG37D, HIS38, LEU39, CYS40, HIS57, CYS58, TYR143, LEU146 and 15 more
- 4CRA · Creating novel F1 inhibitors through fragment based lead generation and structure aided… · XJ8 A1491 · binds ARG37D, HIS38, LEU39, CYS40, HIS57, CYS58, TYR143, LEU146 and 15 more
Residues it binds most
CYS 2, GLY 2, ASP 2, HIS 2, LEU 2, SER 2, ALA 2, ARG 2, ILE 2, LYS 2 (residue and the binding sites it lines).
Found with
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