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

Submission ID: RCG
File name: alatis_output_compound.sdf

Download outputs in JSON format here.

Probabilities of the best carbohydrate fragment:

• Fragment probability: 1.00
• Compound probability: 0.54

List of identified carbohydrate fragments:

• C₁₅H₉N₁O₄
  Fragment probability: 1.00
  Fragment mass: 144.12670000000003
  Fragment main chain atoms: [24, 29, 28, 26, 23]
  Fragment all atoms: [24, 65, 17, 9, 10, 56, 57, 29, 18, 11, 12, 58, 59, 37, 28, 25, 21, 22, 33, 68, 26, 66, 31, 67, 23, 64, 27, 32, 30]
  

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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