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Ligand · 0IF

0IF · 2-amino-6-fluorobenzonitrile

0IF, 2-amino-6-fluorobenzonitrile (C7 H5 F N2, 136.1 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with…

Component
0IF
Formula
C7 H5 F N2
Class
ligand
Structures
1
PDB entries
1

Binding sites

0IF in 1 structure; the first of them:

  • 8DXE · HIV-1 reverse transcriptase/rilpivirine with bound fragment 2-amino-6-fluorobenzonitrile… · 0IF A601 · binds MET164, THR165, LEU168, GLU169, ALA172, ILE180, TYR181, GLN182 and 2 more

Residues it binds most

THR 1, ALA 1, GLN 1, GLU 1, ILE 1, LEU 1, MET 1, PRO 1, TYR 1 (residue and the binding sites it lines).

Found with

  • T27 · 4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile
  • MG · Magnesium ion
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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