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Ligand · Y14

Y14 · N-[(1S)-2-{[(3S)-1-benzyl-3-cyanopyrrolidin-3-yl]amino}-1-(cyclohexylmethyl)-2-oxoethyl]morpholine-4-carboxamide

Y14, N-[(1S)-2-{[(3S)-1-benzyl-3-cyanopyrrolidin-3-yl]amino}-1-(cyclohexylmethyl)-2-oxoethyl]morpholine-4-carboxamide (C26 H37 N5 O3, 467.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
Y14
Formula
C26 H37 N5 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

Y14 in 2 structures; the first of them:

  • 2R9N · Cathepsin S complexed with Compound 26 · Y14 A281 · binds GLN19, GLY23, ALA24, CYS25, TRP26, GLY62, LYS64, ASN67 and 14 more
  • 2R9N · Cathepsin S complexed with compound 26 · Y14 A281 · binds GLN19, GLY23, ALA24, CYS25, TRP26, GLY62, LYS64, ASN67 and 14 more

Residues it binds most

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

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