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

Submission ID: JTZ
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.58
• Compound probability: 0.72

List of identified carbohydrate fragments:

• C₆H₁₃N₁O₂
  Fragment probability: 0.58
  Fragment mass: 132.18030000000002
  Fragment main chain atoms: [11, 14, 10, 16, 12, 2]
  Fragment all atoms: [11, 36, 37, 18, 14, 39, 17, 41, 10, 34, 35, 16, 12, 38, 3, 24, 25, 26, 2, 21, 22, 23]
  

• C₄H₅
  Fragment probability: 0.31
  Fragment mass: 41.0716
  Fragment main chain atoms: [1, 4]
  Fragment all atoms: [1, 19, 20, 4, 27, 7, 30, 31, 13]
  

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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