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

Submission ID: LT6
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.54
• Compound probability: 0.47

List of identified carbohydrate fragments:

• C₆H₈N₁O₃
  Fragment probability: 0.54
  Fragment mass: 131.1295
  Fragment main chain atoms: [15, 18, 25, 21, 16]
  Fragment all atoms: [15, 53, 54, 27, 59, 18, 57, 14, 51, 52, 17, 25, 21, 28, 16, 55, 56, 30]
  

• C₂H₃N₁O₁
  Fragment probability: 0.50
  Fragment mass: 81.09570000000001
  Fragment main chain atoms: [2, 26, 23]
  Fragment all atoms: [2, 34, 35, 36, 26, 23, 29]
  

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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