Ligand · 635
635 · 1-methylethyl 8-fluoro-1,1-dimethyl-3-{[4-(3-morpholin-4-ylpropoxy)phenyl]carbonyl}-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate
635, 1-methylethyl 8-fluoro-1,1-dimethyl-3-{[4-(3-morpholin-4-ylpropoxy)phenyl]carbonyl}-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate (C32 H38 F N3 O5, 563.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…
- Component
- 635
- Formula
- C32 H38 F N3 O5
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
635 in 2 structures; the first of them:
- 3L1B · Complex Structure of FXR Ligand-binding domain with a tetrahydroazepinoindole compound · 635 A1 · binds PHE288, LEU291, THR292, MET294, ALA295, HIS298, MET332, PHE333 and 14 more
- 3L1B · Complex structure of fxr ligand-binding domain with a tetrahydroazepinoindole compound · 635 A1 · binds PHE288, LEU291, THR292, MET294, ALA295, HIS298, MET332, PHE333 and 14 more
Residues it binds most
ILE 2, LEU 2, MET 2, PHE 2, TRP 2, ALA 2, ARG 2, HIS 2, LYS 2, PRO 2 (residue and the binding sites it lines).
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