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

Submission ID: 3L2
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 1.00
• Compound probability: 0.39

List of identified carbohydrate fragments:

• C₁₁H₁₄O₃
  Fragment probability: 1.00
  Fragment mass: 153.15490000000003
  Fragment main chain atoms: [13, 18, 25, 27, 20]
  Fragment all atoms: [13, 59, 60, 18, 66, 36, 25, 3, 26, 43, 44, 45, 10, 19, 14, 54, 55, 67, 61, 62, 27, 15, 63, 64, 34, 20, 68, 35]
  

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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