Ligand · M91
M91 · (2S)-1-{[(2R)-1-{[(2S,3S)-1-cyclohexyl-3-hydroxy-4-(2-oxopyridin-1(2H)-yl)butan-2-yl]amino}-3-(methylsulfanyl)-1-oxopropan-2-yl]amino}-1-oxo-3-phenylpropan-2-yl 4-aminopiperidine-1-carboxylate
M91, (2S)-1-{[(2R)-1-{[(2S,3S)-1-cyclohexyl-3-hydroxy-4-(2-oxopyridin-1(2H)-yl)butan-2-yl]amino}-3-(methylsulfanyl)-1-oxopropan-2-yl]amino}-1-oxo-3-phenylpropan-2-yl 4-aminopiperidine-1-carboxylate (C34 H49 N5 O6 S, 655.9 g/mol), in the…
- Component
- M91
- Formula
- C34 H49 N5 O6 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
M91 in 2 structures; the first of them:
- 1E81 · Endothiapepsin complex with renin inhibitor MERCK-KGAA-EMD61395 · M91 E400 · binds ILE7, ASP12, ALA13, ASP30, ASP32, GLY34, SER74, TYR75 and 18 more
- 1E81 · Endothiapepsin complex with renin inhibitor merck-kgaa-EMD61395 · M91 E400 · binds ILE7, ASP12, ALA13, ASP30, ASP32, GLY34, SER74, TYR75 and 18 more
Residues it binds most
ASP 2, ILE 2, GLY 2, PHE 2, LEU 2, SER 2, THR 2, TYR 2, ALA 2 (residue and the binding sites it lines).
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