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Ligand · 0QN

0QN · N-(trifluoroacetyl)-L-valyl-N-[4-(trifluoromethyl)phenyl]-L-alaninamide

0QN, N-(trifluoroacetyl)-L-valyl-N-[4-(trifluoromethyl)phenyl]-L-alaninamide (C17 H19 F6 N3 O3, 427.3 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, the…

Component
0QN
Formula
C17 H19 F6 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

0QN in 2 structures; the first of them:

  • 1ELE · Structural analysis of the active site of porcine pancreatic elastase based on the X-ray… · 0QN E256 · binds HIS60, VAL103, ALA104, TRP179, THR182, GLY198, CYS199, GLN200 and 9 more
  • 1ELE · Structural analysis of the active site of porcine pancreatic elastase based on the X-ray… · 0QN E256 · binds HIS60, VAL103, ALA104, TRP179, THR182, GLY198, CYS199, GLN200 and 9 more

Residues it binds most

SER 2, GLY 2, THR 2, VAL 2, ALA 2, ARG 2, ASP 2, CYS 2, GLN 2, HIS 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • SO4 · Sulfate ion

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