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Ligand · U4T

U4T · 4H,5H-naphtho[1,2-b]thiophene-2-carboxylic acid

U4T, 4H,5H-naphtho[1,2-b]thiophene-2-carboxylic acid (C13 H10 O2 S, 230.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and…

Component
U4T
Formula
C13 H10 O2 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

U4T in 2 structures; the first of them:

  • 8TAB · RTA-PD00589 · U4T A304 · binds TYR183, SER203, LEU207, LEU232, GLN233, ARG234, ARG235, PHE240 and 3 more
  • 7BN8 · Notum FRAGMENT_3 (4H,5H-NAPHTHO[1,2-B]THIOPHENE-2-carboxylic acid) · U4T A506 · binds GLY127, TRP128, SER232, ALA233, THR236, PHE268, PRO287, PHE319 and 4 more

Residues it binds most

PHE 2, LEU 1, ALA 1, ARG 1, ILE 1, SER 2, GLN 1, GLY 1, HIS 1, PRO 1 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • 2PE · Nonaethylene glycol
  • EDO · 1,2-ethanediol

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