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Ligand · 2FC

2FC · N-[(8R)-8-(benzoylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]-4-methylpiperazine-1-carboxamide

2FC, N-[(8R)-8-(benzoylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]-4-methylpiperazine-1-carboxamide (C23 H28 N4 O2, 392.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
2FC
Formula
C23 H28 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

2FC in 2 structures; the first of them:

  • 4P6E · Crystal Structure of Human Cathepsin S Bound to a Non-covalent Inhibitor · 2FC A302 · binds CYS25, TRP26, GLY62, ASN63, LYS64, ASN67, GLY68, GLY69 and 14 more
  • 4P6E · Crystal structure of human cathepsin S bound to a non-covalent inhibitor · 2FC A302 · binds CYS25, TRP26, GLY62, ASN63, LYS64, ASN67, GLY68, GLY69 and 14 more

Residues it binds most

GLY 4, PHE 4, ASN 4, GLU 4, THR 4, CYS 4, HIS 4, LYS 4, MET 4, TRP 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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