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Ligand · IXM

IXM · (Z)-1H,1'H-[2,3']biindolylidene-3,2'-dione-3-oxime

IXM, (Z)-1H,1'H-[2,3']biindolylidene-3,2'-dione-3-oxime (C16 H11 N3 O2, 277.3 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
IXM
Formula
C16 H11 N3 O2
Class
ligand
Structures
6
PDB entries
3

Binding sites

IXM in 6 structures; the first of them:

  • 1Q41 · GSK-3 Beta complexed with Indirubin-3'-monoxime · IXM A451 · binds ILE62, GLY63, VAL70, ALA83, VAL110, LEU132, ASP133, TYR134 and 8 more
  • 1UNH · Structural mechanism for the inhibition of CDK5-p25 by roscovitine, aloisine and… · IXM A1288 · binds ILE10, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81, PHE82 and 9 more
  • 2QKR · Cryptosporidium parvum cyclin-dependent kinase cgd5_2510 with indirubin 3'-monoxime bound · IXM A401 · binds VAL29, GLU31, VAL37, ALA49, LYS51, VAL82, PHE98, GLU99 and 6 more
  • 1Q41 · Gsk-3 beta complexed with indirubin-3'-monoxime · IXM A451 · binds ILE62, GLY63, VAL70, ALA83, VAL110, LEU132, ASP133, TYR134 and 8 more
  • 1UNH · Structural mechanism for the inhibition of CDK5-P25 by roscovitine, aloisine and… · IXM A1288 · binds ILE10, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81, PHE82 and 9 more
  • 2QKR · Cryptosporidium parvum cyclin-dependent kinase CGD5_2510 with indirubin 3'-monoxime bound · IXM A401 · binds VAL29, GLU31, VAL37, ALA49, LYS51, VAL82, PHE98, GLU99 and 6 more

Residues it binds most

VAL 10, ALA 10, ASP 8, GLU 10, LEU 10, LYS 6, PHE 6, CYS 8, GLN 4, ILE 8 (residue and the binding sites it lines).

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