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Ligand · F5O

F5O · 4-[[(1R)-2-[5-(2-fluoranyl-3-methoxy-phenyl)-3-[[2-fluoranyl-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-1-phenyl-ethyl]amino]butanoic acid

F5O, 4-[[(1R)-2-[5-(2-fluoranyl-3-methoxy-phenyl)-3-[[2-fluoranyl-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-1-phenyl-ethyl]amino]butanoic acid (C32 H30 F5 N3 O5, 631.6 g/mol), in the MolNFT structures…

Component
F5O
Formula
C32 H30 F5 N3 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

F5O in 2 structures; the first of them:

  • 7BR3 · Crystal structure of the protein 1 · F5O A1211 · binds ILE21, PRO22, LEU23, MET24, GLN25, GLY26, ASN27, ASP98 and 19 more
  • 7BR3 · Crystal structure of the protein 1 · F5O A1211 · binds ILE21, PRO22, LEU23, GLN25, GLY26, ASP98, ASN102, ILE103 and 11 more

Residues it binds most

LEU 2, ASN 2, PHE 2, GLY 2, ILE 2, MET 2, TYR 2, ASP 2, GLN 2, LYS 2 (residue and the binding sites it lines).

Found with

  • 1QW · (2R)-2,3-dihydroxypropyl dodecanoate
  • FMT · Formic acid
  • OLC · (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate
  • PEG · Di(hydroxyethyl)ether

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