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Ligand · 5AQ

5AQ · 8-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl) adenosine

5AQ, 8-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl) adenosine (C20 H24 N6 O5 S, 460.5 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…

Component
5AQ
Formula
C20 H24 N6 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

5AQ in 2 structures; the first of them:

  • 5DHP · Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with a novel… · 5AQ A303 · binds LEU49, ASN122, GLU123, ALA162, TYR163, SER166, ASP222, HIS223 and 9 more
  • 5DHP · Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a novel… · 5AQ A303 · binds LEU49, ASN122, GLU123, ALA162, TYR163, SER166, ASP222, HIS223 and 9 more

Residues it binds most

GLY 6, ALA 8, ASP 8, SER 8, ARG 8, ASN 8, GLU 8, HIS 8, ILE 8, LEU 8 (residue and the binding sites it lines).

Found with

  • CIT · Citric acid
  • GOL · Glycerol

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