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Ligand · CDD

CDD · 2-(6-chloro-3-{[2,2-difluoro-2-(1-oxido-2-pyridinyl)ethyl]amino}-2-oxo-1(2H)-pyrazinyl)-N-[(2-fluorophenyl)methyl]acetamide

CDD, 2-(6-chloro-3-{[2,2-difluoro-2-(1-oxido-2-pyridinyl)ethyl]amino}-2-oxo-1(2H)-pyrazinyl)-N-[(2-fluorophenyl)methyl]acetamide (C20 H17 Cl F3 N5 O3, 467.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
CDD
Formula
C20 H17 Cl F3 N5 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

CDD in 2 structures; the first of them:

  • 1MUE · Thrombin-Hirugen-L405,426 · CDD B248 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 12 more
  • 1MUE · Thrombin-hirugen-L405,426 · CDD B248 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 12 more

Residues it binds most

GLU 2, GLY 2, CYS 2, SER 2, TRP 2, ALA 2, ASN 2, ASP 2, HIS 2, ILE 2 (residue and the binding sites it lines).

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