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Ligand · DJT

DJT · (2S,4R)-4-(2-chlorophenyl)sulfonyl-1-[1-(4-fluorophenyl)cyclopropyl]carbonyl-N-[1-(iminomethyl)cyclopropyl]pyrrolidine-2-carboxamide

DJT, (2S,4R)-4-(2-chlorophenyl)sulfonyl-1-[1-(4-fluorophenyl)cyclopropyl]carbonyl-N-[1-(iminomethyl)cyclopropyl]pyrrolidine-2-carboxamide (C25 H25 Cl F N3 O4 S, 518.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
DJT
Formula
C25 H25 Cl F N3 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

DJT in 2 structures; the first of them:

  • 2XU4 · Cathepsin L with a nitrile inhibitor · DJT A1221 · binds GLN19, GLY23, SER24, CYS25, TRP26, GLY61, GLU63, ASN66 and 11 more
  • 2XU4 · Cathepsin L with a nitrile inhibitor · DJT A1221 · binds GLN19, GLY23, SER24, CYS25, TRP26, GLY61, GLU63, ASN66 and 11 more

Residues it binds most

GLY 2, ALA 2, MET 2, ASN 2, ASP 2, CYS 2, GLN 2, GLU 2, HIS 2, LEU 2 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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