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Ligand · OT8

OT8 · ~{N}-[[1-(4-phenoxyphenyl)-1,2,3-triazol-4-yl]methyl]-2-(trifluoromethyl)pyridin-4-amine

OT8, ~{N}-[[1-(4-phenoxyphenyl)-1,2,3-triazol-4-yl]methyl]-2-(trifluoromethyl)pyridin-4-amine (C21 H16 F3 N5 O, 411.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
OT8
Formula
C21 H16 F3 N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

OT8 in 2 structures; the first of them:

  • 6YIZ · Crystal structure of PqsR (MvfR) ligand-binding domain in complex with triazolo-pyridine… · OT8 A402 · binds ALA102, PRO129, ILE149, ALA168, VAL170, HIS184, SER185, ILE186 and 12 more
  • 6YIZ · Crystal structure of pqsr (mvfr) ligand-binding domain in complex with triazolo-pyridine… · OT8 A402 · binds ALA102, ILE149, ALA168, HIS184, SER185, ILE186, LEU189, LEU207 and 8 more

Residues it binds most

ILE 4, LEU 4, ALA 4, PRO 4, HIS 4, PHE 4, SER 4, THR 4, TYR 4, GLN 3 (residue and the binding sites it lines).

Found with

  • OT2 · 7-oxidanylidene-8-[2-(4-sulfonaphthalen-1-yl) hydrazinyl]-8~{H}-naphthalene-1,3-disulfonic acid
  • MG · Magnesium ion

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