Ligand · 916
916 · N-[(2S,3R)-4-{[(4S)-6-(2,2-dimethylpropyl)-2,2-dimethyl-3,4-dihydro-2H-thieno[2,3-b]pyran-4-yl]amino}-3-hydroxy-1-phenylbutan-2-yl]acetamide
916, N-[(2S,3R)-4-{[(4S)-6-(2,2-dimethylpropyl)-2,2-dimethyl-3,4-dihydro-2H-thieno[2,3-b]pyran-4-yl]amino}-3-hydroxy-1-phenylbutan-2-yl]acetamide (C26 H38 N2 O3 S, 458.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…
- Component
- 916
- Formula
- C26 H38 N2 O3 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
916 in 2 structures; the first of them:
- 4EXG · Design and synthesis of potent hydroxyethylamine (hea) bace-1 inhibitors · 916 A500 · binds LEU78, ASP80, GLY82, SER83, VAL117, PRO118, TYR119, THR120 and 15 more
- 4EXG · Design and synthesis of potent hydroxyethylamine (hea) bace-1 inhibitors · 916 A500 · binds LEU78, ASP80, GLY82, SER83, VAL117, PRO118, TYR119, THR120 and 15 more
Residues it binds most
ILE 2, THR 2, ARG 2, ASP 2, GLY 2, TYR 2, VAL 2, GLN 2, LEU 2, LYS 2 (residue and the binding sites it lines).
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