Ligand · 4I1
4I1 · Petroselinic acid
4I1, Petroselinic acid (C18 H34 O2, 282.5 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.
- Component
- 4I1
- Formula
- C18 H34 O2
- Class
- ligand
- Structures
- 5
- PDB entries
- 4
Binding sites
4I1 in 5 structures; the first of them:
- 7FEZ · The 0.76 angstrom X-ray structure of the human heart fatty acid-binding protein complexed… · 4I1 A200 · binds PHE16, TYR19, MET20, LEU23, VAL25, THR29, ALA33, PRO38 and 14 more
- 8K7P · Staphylococcus aureus lipase -PSA complex · 4I1 A406 · binds GLY16, PHE17, TYR29, TYR32, HIS115, SER116, MET117, PRO168 and 13 more
- 8K7Q · Staphylococcus aureus lipase S116A inactive mutant-PSA complex · 4I1 A406 · binds GLY16, PHE17, TYR29, TYR32, HIS115, ALA116, MET117, PRO168 and 13 more
- 8YIB · Staphylococcus aureus lipase -PSA complex - covalent bonding state · 4I1 A405 · binds GLY16, PHE17, TYR29, TYR32, HIS115, SER116, MET117, PRO168 and 12 more
- 7FEZ · The 0.76 ångström X-ray structure of the human heart fatty acid- binding protein… · 4I1 A200 · binds PHE16, MET20, ALA33, THR53, LYS58, ALA75, ASP76, ARG78 and 3 more
Residues it binds most
VAL 7, ALA 8, PHE 8, TYR 8, GLY 6, HIS 6, MET 8, SER 7, LEU 8, ILE 6 (residue and the binding sites it lines).
Found with
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