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Ligand · UKB

UKB · 4-[[3-[2-chloranyl-6-(trifluoromethyl)phenyl]-5-(1~{H}-pyrrol-3-yl)-1,2-oxazol-4-yl]methoxy]-2-fluoranyl-benzoic acid

UKB, 4-[[3-[2-chloranyl-6-(trifluoromethyl)phenyl]-5-(1~{H}-pyrrol-3-yl)-1,2-oxazol-4-yl]methoxy]-2-fluoranyl-benzoic acid (C22 H13 Cl F4 N2 O4, 480.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
UKB
Formula
C22 H13 Cl F4 N2 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

UKB in 2 structures; the first of them:

  • 7NP5 · ROR(gamma)t ligand binding domain in complex with allosteric ligand FM216 · UKB A601 · binds TRP317, ALA321, LEU324, THR325, ILE328, GLN329, LEU353, LYS354 and 17 more
  • 7NP5 · ROR(GAMMA)T ligand binding domain in complex with allosteric ligand FM216 · UKB A601 · binds TRP317, ALA321, LEU324, THR325, ILE328, GLN329, LEU353, LYS354 and 17 more

Residues it binds most

LEU 2, ALA 2, GLN 2, ILE 2, PHE 2, VAL 2, LYS 2, MET 2, PRO 2, THR 2 (residue and the binding sites it lines).

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