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

Submission ID: AAL
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 1.00
• Compound probability: 1.00

List of identified carbohydrate fragments:

• C₆H₉O₄
  Fragment probability: 1.00
  Fragment mass: 132.11430000000001
  Fragment main chain atoms: [10, 5, 3, 2, 1]
  Fragment all atoms: [10, 5, 17, 4, 16, 6, 18, 8, 20, 3, 15, 7, 19, 2, 14, 11, 1, 12, 13]
  

• C₆H₁₀O₅
  Fragment probability: 1.00
  Fragment mass: 178.13960000000006
  Fragment main chain atoms: [11, 6, 4, 5, 3, 2, 9, 18, 21, 8, 16, 20, 7, 15, 19]
  Fragment all atoms: [11, 6, 4, 5, 17, 10, 3, 2, 14, 1, 12, 13, 9, 18, 21, 8, 16, 20, 7, 15, 19]
  

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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