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

Submission ID: M90
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.47
• Compound probability: 0.33

List of identified carbohydrate fragments:

• C₉H₁₁N₂O₄
  Fragment probability: 0.47
  Fragment mass: 213.21
  Fragment main chain atoms: [22, 30, 28, 37, 32, 29, 38, 33]
  Fragment all atoms: [22, 81, 82, 44, 30, 89, 40, 95, 28, 87, 20, 77, 78, 24, 85, 37, 32, 41, 29, 88, 23, 83, 84, 38, 33, 42]
  

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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