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Ligand · I5T

I5T · 4-oxidanylidene-N-[(1S,2R)-2-phenylcyclopropyl]spiro[3H-chromene-2,4'-piperidine]-1'-carboxamide

I5T, 4-oxidanylidene-N-[(1S,2R)-2-phenylcyclopropyl]spiro[3H-chromene-2,4'-piperidine]-1'-carboxamide (C23 H24 N2 O3, 376.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
I5T
Formula
C23 H24 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

I5T in 2 structures; the first of them:

  • 5AM1 · ligand complex structure of soluble epoxide hydrolase · I5T A1552 · binds PHE267, PRO268, ASP335, TRP336, MET339, THR360, PRO361, ILE363 and 12 more
  • 5AM1 · Ligand complex structure of soluble epoxide hydrolase · I5T A1552 · binds PHE267, PRO268, ASP335, TRP336, MET339, THR360, PRO361, ILE363 and 12 more

Residues it binds most

LEU 2, MET 2, PHE 2, PRO 2, TRP 2, TYR 2, ASP 2, GLN 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide

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