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Ligand · NS4

NS4 · N-[2-(cyclohexyloxy)-4-nitrophenyl]methanesulfonamide

NS4, N-[2-(cyclohexyloxy)-4-nitrophenyl]methanesulfonamide (C13 H18 N2 O5 S, 314.4 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…

Component
NS4
Formula
C13 H18 N2 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

NS4 in 2 structures; the first of them:

  • 3QMO · X-ray crystal structure of NS-398 bound to the cyclooxygenase channel of cyclooxygenase-2 · NS4 A704 · binds HIS90, VAL116, ARG120, VAL349, LEU352, SER353, TYR355, LEU359 and 10 more
  • 3QMO · X-ray crystal structure of ns-398 bound to the cyclooxygenase channel of cyclooxygenase-2 · NS4 A619 · binds HIS90, VAL116, ARG120, VAL349, LEU352, SER353, TYR355, LEU359 and 10 more

Residues it binds most

LEU 4, VAL 4, SER 4, TYR 4, ARG 4, ALA 4, GLY 4, HIS 4, MET 4, PHE 4 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • BMA · beta-D-mannopyranose
  • MAN · alpha-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • NDG · 2-acetamido-2-deoxy-alpha-D-glucopyranose
  • BOG · octyl beta-D-glucopyranoside
  • GOL · Glycerol

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