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Ligand · IXP

IXP · (5S,5aS,8aS,9S)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 4-{[4-({[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl}amino)butyl]amino}-4-oxobutanoate

IXP, (5S,5aS,8aS,9S)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 4-{[4-({[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl}amino)butyl]amino}-4-oxobutanoate (C49 H50 Cl…

Component
IXP
Formula
C49 H50 Cl N3 O13
Class
ligand
Structures
2
PDB entries
1

Binding sites

IXP in 2 structures; the first of them:

  • 4OTJ · The complex of murine cyclooxygenase-2 with a conjugate of indomefathin and… · IXP A706 · binds LYS79, LEU82, LYS83, VAL89, HIS90, LEU93, TYR115, VAL116 and 18 more
  • 4OTJ · The complex of murine cyclooxygenase-2 with a conjugate of indomefathin and… · IXP A706 · binds LYS79, LEU82, LYS83, VAL89, HIS90, LEU93, TYR115, VAL116 and 18 more

Residues it binds most

LEU 8, VAL 8, TYR 8, SER 8, LYS 8, PHE 8, ARG 8, ALA 8, GLY 8, HIS 8 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • BOG · octyl beta-D-glucopyranoside

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