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

Submission ID: LSW
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.48
• Compound probability: 0.53

List of identified carbohydrate fragments:

• C₁₂H₁₅N₂O₅
  Fragment probability: 0.48
  Fragment mass: 229.20940000000002
  Fragment main chain atoms: [26, 23, 30, 22, 25, 31, 24, 27]
  Fragment all atoms: [26, 34, 33, 69, 23, 62, 14, 54, 55, 13, 52, 53, 30, 22, 61, 12, 50, 51, 6, 42, 43, 25, 32, 31, 24, 63, 16, 58, 59, 19, 27, 36, 35, 70]
  

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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