• Example saccharides
• Example non-saccharides
• RCSB Ligand Expo entries
• Saccharide entries in Ligand Expo
• Saccharide fingerprints

Submission ID: 6EU
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.39
• Compound probability: 0.24

List of identified carbohydrate fragments:

• C₇H₇O₂
  Fragment probability: 0.39
  Fragment mass: 68.07379999999999
  Fragment main chain atoms: [20, 43, 31]
  Fragment all atoms: [20, 79, 80, 26, 14, 18, 69, 75, 76, 43, 31, 16, 71, 72, 25, 39]
  

• C₂H₃
  Fragment probability: 0.38
  Fragment mass: 69.0817
  Fragment main chain atoms: [2, 21]
  Fragment all atoms: [2, 49, 50, 51, 21]
  

Most similar ligands:

Citation:

• Hesam Dashti, William M. Westler, Jonathan R. Wedell, Olga V. Demler, Hamid R. Eghbalnia, John L. Markley & Samia Mora, Probabilistic identification of saccharide moieties in biomolecules and their protein complexes, Scientific Data volume 7, Article number: 210 (2020), https://doi.org/10.1038/s41597-020-0547-y, https://www.nature.com/articles/s41597-020-0547-y

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