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Ligand · 3TX

3TX · 4-[4-(quinolin-2-yl)-1H-1,2,3-triazol-1-yl]phenol

3TX, 4-[4-(quinolin-2-yl)-1H-1,2,3-triazol-1-yl]phenol (C17 H12 N4 O, 288.3 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 most and…

Component
3TX
Formula
C17 H12 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

3TX in 2 structures; the first of them:

  • 4WR8 · Macrophage Migration Inhibitory Factor in complex with a biaryltriazole inhibitor (3b-180) · 3TX C201 · binds TYR95, ASN97, PRO1, MET2, LYS32, PRO33, TYR36, HIS62 and 8 more
  • 4WR8 · Macrophage migration inhibitory factor in complex with a biaryltriazole inhibitor (3B-180) · 3TX C201 · binds TYR95, ASN97, PRO1, MET2, LYS32, PRO33, TYR36, HIS62 and 8 more

Residues it binds most

TYR 12, MET 12, PRO 12, PHE 12, ASN 12, HIS 12, ILE 12, LYS 12, SER 12, VAL 12 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • SO4 · Sulfate ion

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