Ligand · C71

C71 · N-[4-(aminomethyl)-1,1-dioxidotetrahydro-2H-thiopyran-4-yl]-3-(1-methylcyclopentyl)-N~2~-[(1E)-N-(phenylsulfonyl)ethanimidoyl]-L-alaninamide

C71, N-[4-(aminomethyl)-1,1-dioxidotetrahydro-2H-thiopyran-4-yl]-3-(1-methylcyclopentyl)-N~2~-[(1E)-N-(phenylsulfonyl)ethanimidoyl]-L-alaninamide (C23 H36 N4 O5 S2, 512.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component: C71
Formula: C23 H36 N4 O5 S2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

C71 in 2 structures; the first of them:

2FRQ · Human Cathepsin S with Inhibitor CRA-26871 · C71 A1000 · binds GLN19, GLY23, ALA24, CYS25, TRP26, ASN64, GLY65, GLY66 and 8 more
2FRQ · Human cathepsin S with inhibitor cra-26871 · C71 A1000 · binds GLN19, GLY23, ALA24, CYS25, TRP26, ASN64, GLY65, GLY66 and 8 more

Residues it binds most

GLY 4, ASN 4, PHE 4, ALA 4, CYS 4, GLN 4, HIS 4, MET 4, TRP 4, VAL 4 (residue and the binding sites it lines).

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