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Ligand · 3IM

3IM · 2,6-ditert-butyl-4-methyl-phenol

3IM, 2,6-ditert-butyl-4-methyl-phenol (C15 H24 O, 220.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
3IM
Formula
C15 H24 O
Class
ligand
Structures
2
PDB entries
2

Binding sites

3IM in 2 structures; the first of them:

  • 7FBM · X-ray structure of high-strength hydrogel-grown FABP3 crystal soaked in 50% dmso solution… · 3IM A202 · binds TYR19, MET20, LEU23, THR29, PRO38, LYS58, ALA75, ASP76 and 1 more
  • 7FBN · X-ray structure of high-strength hydrogel-grown FABP3 crystal soaked in 50% dmf solution… · 3IM A202 · binds PHE16, LEU23, THR29, PRO38, SER55, ALA75, ASP76, ARG78

Residues it binds most

ALA 2, ARG 2, ASP 2, LEU 2, PRO 2, THR 2, LYS 1, MET 1, PHE 1, SER 1 (residue and the binding sites it lines).

Found with

  • ACY · Acetic acid

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