| Cheminformatics Tool for Probabilistic Identification of Carbohydrates (CTPIC) v 1.1 (Spring 2020) |
|||||||||||||||
|
Home Process a structure file Publication files: |
Submission ID: DK5
|
|
Formula: C17F1H18N3O5 Compound mass: 363.33959999999996 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C6H10N1O3
Fragment probability: 1.00
Fragment mass: 144.1481
Fragment main chain atoms: [8, 11, 15, 12, 26, 14, 41, 23, 44]
Fragment all atoms: [8, 34, 35, 11, 38, 15, 12, 39, 9, 36, 37, 22, 43, 26, 14, 40, 21, 41, 23, 44]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| DK5 | 3L7D |
| DKY | 3L7A |
| FSD | 6CZR |
| DKZ | 3L7B |
| XCY | 1YFH |