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

Submission ID: DR7
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 0.50
• Compound probability: 0.65

List of identified carbohydrate fragments:

• C₂₁H₃₃N₅O₇
  Fragment probability: 0.50
  Fragment mass: 397.3624
  Fragment main chain atoms: [7, 50, 35, 41, 31, 33, 40, 29, 30, 24, 44, 43, 34, 32, 42, 36, 51, 8]
  Fragment all atoms: [7, 70, 71, 72, 50, 35, 48, 41, 31, 97, 37, 1, 2, 3, 52, 53, 54, 55, 56, 57, 58, 59, 60, 33, 46, 40, 29, 95, 22, 89, 90, 25, 30, 96, 45, 103, 24, 93, 94, 44, 43, 34, 47, 32, 98, 38, 4, 5, 6, 61, 62, 63, 64, 65, 66, 67, 68, 69, 42, 36, 49, 51, 8, 73, 74, 75]
  

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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