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Ligand · 1HX

1HX · N-[(1S)-1-(2-chloro-6-fluorophenyl)ethyl]-5-cyano-1-methyl-1H-pyrrole-2-carboxamide

1HX, N-[(1S)-1-(2-chloro-6-fluorophenyl)ethyl]-5-cyano-1-methyl-1H-pyrrole-2-carboxamide (C15 H13 Cl F N3 O, 305.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
1HX
Formula
C15 H13 Cl F N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

1HX in 2 structures; the first of them:

  • 4ITJ · Crystal structure of RIP1 kinase in complex with necrostatin-4 · 1HX A301 · binds LYS45, MET67, LEU70, VAL75, VAL76, LYS77, LEU78, LEU90 and 11 more
  • 4ITJ · Crystal structure of RIP1 kinase in complex with necrostatin-4 · 1HX A301 · binds LYS45, MET67, LEU70, VAL75, VAL76, LYS77, LEU78, LEU90 and 11 more

Residues it binds most

LEU 4, VAL 4, LYS 4, MET 4, ALA 4, ASP 4, HIS 4, ILE 4, PHE 4, SER 4 (residue and the binding sites it lines).

Found with

  • IOD · Iodide ion

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