| Cheminformatics Tool for Probabilistic Identification of Carbohydrates (CTPIC) v 1.1 (Spring 2020) |
|||||||||||||||
|
Home Process a structure file Publication files: |
Submission ID: C4L
|
|
Formula: C8H15N1O4 Compound mass: 189.2084000000001 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C4H7N1O3
Fragment probability: 0.72
Fragment mass: 118.1109
Fragment main chain atoms: [5, 4, 6, 8]
Fragment all atoms: [5, 23, 24, 10, 27, 4, 21, 22, 6, 25, 9, 8, 13, 12, 28]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| C4L | 4G9E |
| C6L | 4ZO3 3DHB 4G8C 3DHA |
| 1K4 | 4J5H |
| MV2 | 3AVP |
| SN0 | 2FG7 2FG6 3L04 3L02 3L05 3L06 |