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

Submission ID: EPD
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.38
• Compound probability: 0.24

List of identified carbohydrate fragments:

• C₇H₈O₁
  Fragment probability: 0.36
  Fragment mass: 127.11769999999997
  Fragment main chain atoms: [18, 22, 33]
  Fragment all atoms: [18, 3, 13, 41, 42, 43, 65, 21, 22, 71, 12, 63, 64, 11, 62, 33]
  

• C₂H₃
  Fragment probability: 0.38
  Fragment mass: 69.0817
  Fragment main chain atoms: [3, 18]
  Fragment all atoms: [3, 41, 42, 43, 18]
  

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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