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

Submission ID: UNF
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:

• C₆H₉O₇
  Fragment probability: 1.00
  Fragment mass: 193.1311000000001
  Fragment main chain atoms: [5, 6, 11, 23, 8, 7, 15, 28, 36, 16, 29, 37, 21, 32, 40]
  Fragment all atoms: [5, 6, 11, 23, 8, 31, 10, 19, 20, 39, 7, 30, 24, 15, 28, 36, 16, 29, 37, 21, 32, 40]
  

• C₆H₇O₆
  Fragment probability: 1.00
  Fragment mass: 175.11590000000007
  Fragment main chain atoms: [3, 22, 12, 4, 2, 1, 14, 27, 35, 13, 26, 34]
  Fragment all atoms: [3, 9, 17, 18, 38, 22, 12, 33, 24, 4, 2, 1, 25, 14, 27, 35, 13, 26, 34]
  

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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