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Ligand · NIM

NIM · 4-nitro-2-phenoxymethanesulfonanilide

NIM, 4-nitro-2-phenoxymethanesulfonanilide (C13 H12 N2 O5 S, 308.3 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
NIM
Formula
C13 H12 N2 O5 S
Class
ligand
Structures
10
PDB entries
5

Binding sites

NIM in 10 structures; the first of them:

  • 1ZWP · The atomic resolution Crystal structure of the Phospholipase A2 (PLA2) complex with… · NIM A401 · binds LEU2, TYR28, CYS29, GLY30, TRP31, GLY32, ASP49, LYS69
  • 2OTH · Crystal structure of a ternary complex of phospholipase A2 with indomethacin and… · NIM A300 · binds LEU2, ALA18, ILE19, SER23, GLY30, LYS69
  • 3E9X · Crystal Structure of the Complex of C-lobe of Lactoferrin with Nimesulide at 2.7 A… · NIM A1 · binds GLU659, GLY662, THR663, GLU664
  • 3N8X · Crystal Structure of Cyclooxygenase-1 in Complex with Nimesulide · NIM A701 · binds HIS90, VAL116, ARG120, GLN192, VAL349, LEU352, SER353, TYR355 and 12 more
  • 4EIX · Structural Studies of the ternary complex of Phaspholipase A2 with nimesulide and… · NIM A201 · binds LEU2, PHE5, GLY6, ILE9, ALA18, ILE19, SER23, GLY30 and 1 more
  • 1ZWP · The atomic resolution crystal structure of the phospholipase A2 (PLA2) complex with… · NIM A401 · binds LEU2, TYR28, CYS29, GLY30, TRP31, GLY32, ASP49, LYS69
  • 2OTH · Crystal structure of a ternary complex of phospholipase A2 with indomethacin and… · NIM A300 · binds LEU2, ALA18, ILE19, SER23, GLY30, LYS69
  • 3E9X · Crystal structure of the complex of C-lobe of lactoferrin with nimesulide at 2.7 a… · NIM A1 · binds GLU659, GLY662, THR663, GLU664
  • 3N8X · Crystal structure of cyclooxygenase-1 in complex with nimesulide · NIM A701 · binds HIS90, VAL116, ARG120, GLN192, VAL349, LEU352, SER353, TYR355 and 12 more
  • 4EIX · Structural studies of the ternary complex of phaspholipase A2 with nimesulide and… · NIM A201 · binds LEU2, PHE5, GLY6, ILE9, ALA18, ILE19, SER23, GLY30 and 1 more

Residues it binds most

LEU 10, GLY 12, ILE 8, SER 8, TYR 6, ALA 8, VAL 4, LYS 6, PHE 6, TRP 6 (residue and the binding sites it lines).

Found with

  • CCN · Acetonitrile
  • IMN · Indomethacin
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion
  • HEM · Protoporphyrin IX containing Fe
  • FE · Fe (III) ion
  • ZN · Zinc ion
  • BMA · beta-D-mannopyranose
  • MAN · alpha-D-mannopyranose
  • CO3 · Carbonate ion
  • BOG · octyl beta-D-glucopyranoside
  • MOH · Methanol

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