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Ligand · R4N

R4N · 4-[(3-chlorophenyl)methyl]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide

R4N, 4-[(3-chlorophenyl)methyl]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide (C25 H21 Cl N2 O4 S, 481.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
R4N
Formula
C25 H21 Cl N2 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

R4N in 2 structures; the first of them:

  • 5ALG · ligand complex structure of soluble epoxide hydrolase · R4N A1551 · binds PHE267, PRO268, ASP335, TRP336, MET339, THR360, PHE381, TYR383 and 13 more
  • 5ALG · Ligand complex structure of soluble epoxide hydrolase · R4N A1551 · binds PHE267, PRO268, ASP335, TRP336, MET339, THR360, PHE381, TYR383 and 13 more

Residues it binds most

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

Found with

  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide

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