| Cheminformatics Tool for Probabilistic Identification of Carbohydrates (CTPIC) v 1.1 (Spring 2020) |
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Home Process a structure file Publication files: |
Submission ID: GBA
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Formula: Br1C10H12N5O4 Compound mass: 346.1369 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C5H9N1O4
Fragment probability: 1.00
Fragment mass: 147.12890000000002
Fragment main chain atoms: [5, 6, 9, 20, 3]
Fragment all atoms: [5, 25, 18, 31, 6, 26, 19, 32, 9, 27, 16, 20, 3, 24, 1, 21, 22, 17, 30]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| GBA | 6DFO |
| 5NB | 3V8R 3V8N |
| Z8B | 3V8M 3QYZ |
| 8BR | 5RHN 5O0J 1RO9 |
| RAB | 3GLQ 1PW7 |