Ligand · C8D
C8D · N-[(cyclopentyloxy)carbonyl]-3-methyl-L-valyl-(4R)-N-{(1R)-3-hydroxy-1-[hydroxy(oxido)boranyl]propyl}-4-(isoquinolin-1-yloxy)-L-prolinamide
C8D, N-[(cyclopentyloxy)carbonyl]-3-methyl-L-valyl-(4R)-N-{(1R)-3-hydroxy-1-[hydroxy(oxido)boranyl]propyl}-4-(isoquinolin-1-yloxy)-L-prolinamide (C29 H40 B N4 O8 -1, 583.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records…
- Component
- C8D
- Formula
- C29 H40 B N4 O8 -1
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
C8D in 2 structures; the first of them:
- 2XCN · Crystal structure of HCV NS3 protease with a boronate inhibitor · C8D A1181 · binds GLN41, THR42, PHE43, HIS57, ASP81, ARG123, ILE132, LEU135 and 11 more
- 2XCN · Crystal structure of HCV NS3 protease with a boronate inhibitor · C8D A1181 · binds GLN41, THR42, PHE43, HIS57, ASP81, ARG123, ILE132, LEU135 and 11 more
Residues it binds most
ALA 4, ARG 4, ASP 4, PHE 4, SER 4, CYS 4, GLY 4, HIS 4, ILE 4, LEU 4 (residue and the binding sites it lines).
Found with
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