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Ligand · GDI

GDI · (2S)-N-[(2S)-1-azanylidene-3-[4-(4-cyanophenyl)phenyl]propan-2-yl]piperidine-2-carboxamide

GDI, (2S)-N-[(2S)-1-azanylidene-3-[4-(4-cyanophenyl)phenyl]propan-2-yl]piperidine-2-carboxamide (C22 H24 N4 O, 360.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
GDI
Formula
C22 H24 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

GDI in 2 structures; the first of them:

  • 4CDD · Human DPP1 in complex with (2S)-N-((1S)-1-cyano-2-(4-(4-cyanophenyl)… · GDI B1369 · binds ASP1, THR2, PRO3, TYR64, GLN228, GLY232, SER233, CYS234 and 10 more
  • 4CDD · Human DPP1 in complex with (2S)-N-((1S)-1-cyano-2-(4-(4-cyanophenyl)… · GDI B1369 · binds ASP1, THR2, PRO3, TYR64, GLN228, GLY232, SER233, CYS234 and 10 more

Residues it binds most

GLY 4, ALA 4, CYS 4, THR 4, TYR 4, ASN 4, ASP 4, GLN 4, GLU 4, HIS 4 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • CL · Chloride ion

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