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

Submission ID: EGZ
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 1.00
• Compound probability: 0.67

List of identified carbohydrate fragments:

• C₆H₁₁O₆
  Fragment probability: 1.00
  Fragment mass: 179.14750000000006
  Fragment main chain atoms: [11, 10, 8, 6, 30, 17, 25, 46, 57, 24, 45, 56, 22, 43, 54]
  Fragment all atoms: [11, 10, 8, 6, 41, 2, 36, 37, 20, 52, 30, 17, 49, 32, 25, 46, 57, 24, 45, 56, 22, 43, 54]
  

• C₆H₉O₅
  Fragment probability: 1.00
  Fragment mass: 161.13230000000001
  Fragment main chain atoms: [12, 9, 7, 31, 18, 14, 23, 44, 55]
  Fragment all atoms: [12, 47, 32, 9, 7, 42, 3, 38, 39, 21, 53, 31, 18, 50, 29, 14, 48, 23, 44, 55]
  

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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