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Ligand · NEE

NEE · 1-[3-(4-chloro-3,5-dimethylphenoxy)benzyl]-1H-imidazole

NEE, 1-[3-(4-chloro-3,5-dimethylphenoxy)benzyl]-1H-imidazole (C18 H17 Cl N2 O, 312.8 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 residues it binds…

Component
NEE
Formula
C18 H17 Cl N2 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

NEE in 2 structures; the first of them:

  • 4H6O · Sterol 14-alpha demethylase (CYP51)from Trypanosoma cruzi in complex with the inhibitor… · NEE A502 · binds PHE110, ALA115, TYR116, MET123, GLN126, LEU127, LEU130, MET284 and 6 more
  • 4H6O · Sterol 14-alpha demethylase (CYP51)FROM trypanosoma cruzi in complex with the inhibitor… · NEE A502 · binds PHE110, ALA115, TYR116, MET123, GLN126, LEU127, LEU130, MET284 and 6 more

Residues it binds most

ALA 2, LEU 2, MET 2, CYS 2, GLN 2, PHE 2, THR 2, TYR 2 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe

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