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Ligand · SY1

SY1 · 2-({2-[(3R)-3-aminopiperidin-1-yl]-4-oxoquinazolin-3(4H)-yl}methyl)benzonitrile

SY1, 2-({2-[(3R)-3-aminopiperidin-1-yl]-4-oxoquinazolin-3(4H)-yl}methyl)benzonitrile (C21 H21 N5 O, 359.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
SY1
Formula
C21 H21 N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

SY1 in 2 structures; the first of them:

  • 2ONC · Crystal structure of human DPP-4 · SY1 A800 · binds ARG125, GLU205, GLU206, PHE357, TYR547, TRP629, SER630, TYR631 and 7 more
  • 2ONC · Crystal structure of human dpp-4 · SY1 A800 · binds ARG125, GLU205, GLU206, PHE357, TYR547, TRP629, SER630, TYR631 and 7 more

Residues it binds most

TYR 16, VAL 16, GLU 16, TRP 16, ARG 16, PHE 16, ASN 8, ASP 8, GLN 8, HIS 8 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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