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

Submission ID: ZM3
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 1.00
• Compound probability: 0.44

List of identified carbohydrate fragments:

• C₆H₁₀O₅
  Fragment probability: 1.00
  Fragment mass: 162.14020000000005
  Fragment main chain atoms: [34, 32, 30, 24, 46, 36, 100, 42, 107, 98, 40, 105]
  Fragment all atoms: [34, 102, 43, 32, 30, 24, 94, 6, 64, 65, 66, 46, 36, 104, 44, 100, 42, 107, 98, 40, 105]
  

• C₆H₁₀N₁O₃
  Fragment probability: 1.00
  Fragment mass: 144.14810000000003
  Fragment main chain atoms: [31, 26, 18, 23, 45, 35, 99, 41, 106]
  Fragment all atoms: [31, 26, 96, 37, 18, 86, 87, 23, 93, 5, 61, 62, 63, 45, 35, 103, 48, 99, 41, 106]
  

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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