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Ligand · 8B2

8B2 · (1R)-1-[4-(morpholin-4-yl)phenyl]ethan-1-amine

8B2, (1R)-1-[4-(morpholin-4-yl)phenyl]ethan-1-amine (C12 H18 N2 O, 206.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
8B2
Formula
C12 H18 N2 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

8B2 in 2 structures; the first of them:

  • 5SBR · CD44 PanDDA analysis group deposition -- The hyaluronan-binding domain of CD44 in complex… · 8B2 A201 · binds ARG33, PHE38, PHE60, SER62, ASN125, ASP133, THR135, SER136 and 4 more
  • 5SBR · CD44 pandda analysis group deposition -- the hyaluronan-binding domain of CD44 in complex… · 8B2 A201 · binds ARG33, PHE38, PHE60, SER62, ASN125, THR135, SER136, VAL137 and 2 more

Residues it binds most

PHE 2, SER 2, THR 2, ARG 2, ASN 2, ASP 1, PRO 2, VAL 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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