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Ligand · SAF

SAF · 3-[(1S)-1-(dimethylamino)ethyl]phenol

SAF, 3-[(1S)-1-(dimethylamino)ethyl]phenol (C10 H15 N O, 165.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…

Component
SAF
Formula
C10 H15 N O
Class
ligand
Structures
4
PDB entries
2

Binding sites

SAF in 4 structures; the first of them:

  • 1GQR · Acetylcholinesterase (E.C. 3.1.1.7) complexed with rivastigmine · SAF A1998 · binds TRP84, GLY117, GLY118, GLY119, TYR130, GLU199, SER200, PHE330 and 1 more
  • 1GQS · Acetylcholinesterase (E.C. 3.1.1.7) complexed with nap · SAF A603 · binds TRP84, GLY118, GLY119, TYR121, TYR130, GLU199, SER200, PHE290 and 5 more
  • 1GQR · Acetylcholinesterase (E.C. 3.1.1.7) complexed with rivastigmine · SAF A1998 · binds TRP84, GLY117, GLY118, GLY119, TYR130, GLU199, SER200, PHE330 and 1 more
  • 1GQS · Acetylcholinesterase (E.C. 3.1.1.7) complexed with nap · SAF A603 · binds TRP84, GLY118, GLY119, TYR121, TYR130, GLU199, SER200, PHE290 and 5 more

Residues it binds most

GLY 4, PHE 4, TYR 4, GLU 4, HIS 4, SER 4, TRP 4, ILE 2 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • EMM · [methyl(vinyl)amino]methanol

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