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Ligand · VOR

VOR · Voriconazole

VOR, Voriconazole (C16 H14 F3 N5 O, 349.3 g/mol), in the MolNFT structures on GenesisL1: bound in 11 records (6 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
VOR
Formula
C16 H14 F3 N5 O
Class
ligand
Structures
11
PDB entries
6

Binding sites

VOR in 11 structures; the first of them:

  • 5HS1 · Saccharomyces cerevisiae CYP51 (Lanosterol 14-alpha demethylase) complexed with… · VOR A602 · binds TYR126, PHE134, ILE139, PHE236, GLY310, GLY314, THR318, LEU380 and 2 more
  • 6AY6 · Naegleria fowleri CYP51-voriconazole complex · VOR A501 · binds TYR107, MET110, PHE114, VAL119, TYR120, ALA289, GLY290, PHE292 and 6 more
  • 6H1O · Structure of the BM3 heme domain in complex with voriconazole · VOR A502 · binds LEU75, VAL78, PHE82, VAL87, THR88, LEU181, THR260, ILE263 and 5 more
  • 7RY8 · S. CEREVISIAE CYP51 Y140H mutant COMPLEXED WITH Voriconazole · VOR A602 · binds TYR126, LEU129, THR130, PHE134, ILE139, HIS140, PHE236, GLY310 and 8 more
  • 7RY9 · S. CEREVISIAE CYP51 I471T mutant COMPLEXED WITH Voriconazole · VOR A602 · binds TYR126, LEU129, THR130, PHE134, ILE139, TYR140, PHE236, GLY310 and 8 more
  • 7RYB · S. CEREVISIAE CYP51 Y140H/I471T - double mutant COMPLEXED WITH Voriconazole · VOR A602 · binds TYR126, THR130, PHE134, ILE139, HIS140, PHE236, GLY310, VAL311 and 7 more
  • 6AY6 · Naegleria fowleri CYP51-voriconazole complex · VOR A501 · binds TYR107, PHE114, TYR120, ALA289, PHE292, ALA293, THR297, LEU358 and 3 more
  • 6H1O · Structure of the BM3 heme domain in complex with voriconazole · VOR A502 · binds LEU75, VAL78, PHE82, VAL87, THR88, LEU181, THR260, ILE263 and 5 more
  • 7RY8 · S. cerevisiae CYP51 Y140H mutant complexed with voriconazole · VOR A602 · binds TYR126, PHE134, ILE139, HIS140, PHE236, GLY310, VAL311, GLY314 and 6 more
  • 7RY9 · S. cerevisiae CYP51 I471T mutant complexed with voriconazole · VOR A602 · binds TYR126, THR130, PHE134, ILE139, TYR140, PHE236, GLY310, VAL311 and 7 more
  • 7RYB · S. cerevisiae CYP51 Y140H/I471T - double mutant complexed with voriconazole · VOR A602 · binds TYR126, THR130, PHE134, ILE139, HIS140, PHE236, GLY310, VAL311 and 5 more

Residues it binds most

LEU 13, THR 13, PHE 13, GLY 8, TYR 9, VAL 11, ILE 11, MET 8, ALA 6, SER 6 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • BGC · beta-D-glucopyranose
  • PO4 · Phosphate ion
  • 1PE · Pentaethylene glycol
  • EDO · 1,2-ethanediol
  • GOL · Glycerol
  • PG4 · Tetraethylene glycol

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