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Ligand · 6CE

6CE · 5'-S-[(S)-hydroxy{[2-(1H-indol-3-yl)ethyl]amino}phosphoryl]-5'-thioguanosine

6CE, 5'-S-[(S)-hydroxy{[2-(1H-indol-3-yl)ethyl]amino}phosphoryl]-5'-thioguanosine (C20 H24 N7 O6 P S, 521.5 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…

Component
6CE
Formula
C20 H24 N7 O6 P S
Class
ligand
Structures
2
PDB entries
1

Binding sites

6CE in 2 structures; the first of them:

  • 5IPC · Human Histidine Triad Nucleotide Binding Protein 1 (hHint1) H112N mutant nucleoside… · 6CE A201 · binds ILE18, PHE19, ILE22, PHE41, HIS42, ASP43, ILE44, SER45 and 14 more
  • 5IPC · Human histidine triad nucleotide binding protein 1 (HHINT1) H112N mutant nucleoside… · 6CE A201 · binds ILE18, PHE19, ILE22, PHE41, HIS42, ASP43, ILE44, SER45 and 14 more

Residues it binds most

HIS 2, ILE 2, ASN 2, GLN 2, PHE 2, SER 2, ARG 2, ASP 2, GLY 2, LEU 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • EDO · 1,2-ethanediol

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