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Ligand · LUR

LUR · {2-[(2-chloro-6-fluorophenyl)amino]-5-methylphenyl}acetic acid

LUR, {2-[(2-chloro-6-fluorophenyl)amino]-5-methylphenyl}acetic acid (C15 H13 Cl F N O2, 293.7 g/mol), in the MolNFT structures on GenesisL1: bound in 12 records (6 PDB entries). Every binding site with its residues within 4.5 Å, the…

Component
LUR
Formula
C15 H13 Cl F N O2
Class
ligand
Structures
12
PDB entries
6

Binding sites

LUR in 12 structures; the first of them:

  • 4IIZ · Crystal structure of wild-type human transthyretin in complex with lumiracoxib · LUR A201 · binds LYS15, LEU17, ALA108, THR119, VAL121
  • 4IK6 · Crystal structure of human transthyretin in complex with lumiracoxib · LUR A201 · binds LYS15, LEU17, THR106, ALA108, VAL121
  • 4OTY · Crystal structure of lumiracoxib bound to the apo-mouse-cyclooxygenase-2 · LUR A705 · binds PHE205, TYR348, VAL349, LEU352, SER353, TYR355, PHE381, LEU384 and 9 more
  • 4RRW · Crystal Structure of Apo Murine Cyclooxygenase-2 · LUR A705 · binds ARG120, PHE205, TYR348, VAL349, LEU352, SER353, TYR355, PHE381 and 9 more
  • 4RRX · Crystal Structure of Apo Murine V89W Cyclooxygenase-2 Complexed with Lumiracoxib · LUR A706 · binds ARG120, TYR348, VAL349, LEU352, SER353, TYR355, PHE381, LEU384 and 8 more
  • 4RRZ · Crystal Structure of Apo Murine H90W Cyclooxygenase-2 Complexed with Lumiracoxib · LUR A705 · binds ARG120, PHE205, TYR348, VAL349, LEU352, SER353, TYR355, PHE381 and 9 more
  • 4IIZ · Crystal structure of wild-type human transthyretin in complex with lumiracoxib · LUR A201 · binds LYS15, LEU17, ALA108, THR119, VAL121
  • 4IK6 · Crystal structure of human transthyretin in complex with lumiracoxib · LUR A201 · binds LYS15, LEU17, THR106, ALA108, VAL121
  • 4OTY · Crystal structure of lumiracoxib bound to the apo-mouse- cyclooxygenase-2 · LUR A705 · binds PHE205, TYR348, VAL349, LEU352, SER353, TYR355, PHE381, LEU384 and 9 more
  • 4RRW · Crystal structure of apo murine cyclooxygenase-2 · LUR A705 · binds ARG120, PHE205, TYR348, VAL349, LEU352, SER353, TYR355, PHE381 and 9 more
  • 4RRX · Crystal structure of apo murine V89W cyclooxygenase-2 complexed with lumiracoxib · LUR A706 · binds ARG120, TYR348, VAL349, LEU352, SER353, TYR355, PHE381, LEU384 and 8 more
  • 4RRZ · Crystal structure of apo murine H90W cyclooxygenase-2 complexed with lumiracoxib · LUR A705 · binds ARG120, PHE205, TYR348, VAL349, LEU352, SER353, TYR355, PHE381 and 9 more

Residues it binds most

LEU 32, TYR 24, VAL 32, PHE 24, SER 24, ALA 32, MET 26, GLY 24, TRP 24, ARG 12 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • BOG · octyl beta-D-glucopyranoside

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