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

Submission ID: GC2
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 1.00
• Compound probability: 0.75

List of identified carbohydrate fragments:

• C₇H₁₂N₂O₃
  Fragment probability: 1.00
  Fragment mass: 187.19590000000008
  Fragment main chain atoms: [4, 12, 8, 10, 9, 6]
  Fragment all atoms: [4, 24, 25, 12, 8, 28, 7, 27, 2, 20, 21, 14, 32, 10, 30, 16, 34, 9, 29, 15, 33, 6, 26, 11]
  

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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