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

Submission ID: 0ED
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.45
• Compound probability: 0.33

List of identified carbohydrate fragments:

• C₉H₁₀N₂O₄
  Fragment probability: 0.45
  Fragment mass: 186.16490000000005
  Fragment main chain atoms: [23, 45, 33, 35, 14, 13, 27, 32]
  Fragment all atoms: [23, 82, 83, 26, 11, 12, 60, 61, 45, 33, 43, 35, 14, 64, 65, 13, 62, 63, 27, 85, 36, 32, 41, 42, 92]
  

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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