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Ligand · 6L5

6L5 · (3R)-4-amino-3-{[6-({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]carbonyl}amino)hexanoyl]amino}-4-oxobutanoic acid (non-preferred name)

6L5, (3R)-4-amino-3-{[6-({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]carbonyl}amino)hexanoyl]amino}-4-oxobutanoic acid (non-preferred name) (C20 H28 N8 O8, 508.5 g/mol), in the MolNFT structures on…

Component
6L5
Formula
C20 H28 N8 O8
Class
ligand
Structures
1
PDB entries
1

Binding sites

6L5 in 1 structure; the first of them:

  • 5HTB · Crystal structure of haspin (GSG2) in complex with bisubstrate inhibitor ARC-3353 · 6L5 C101 · binds ILE490, GLY491, GLU492, GLY493, VAL494, PHE495, GLY496, VAL498 and 18 more

Residues it binds most

GLY 1, ILE 1, LYS 1, PHE 1, ASP 1, GLU 1, VAL 1, ALA 1, ARG 1, GLN 1 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • DMS · Dimethyl sulfoxide
  • MPD · (4S)-2-methyl-2,4-pentanediol
  • MRD · (4R)-2-methylpentane-2,4-diol

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