| 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: MYM
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Formula: C31H51N2O9P1S1 Compound mass: 658.7813999999972 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: 0.62
Fragment mass: 130.1414
Fragment main chain atoms: [18, 28, 25, 26]
Fragment all atoms: [18, 83, 84, 42, 28, 2, 3, 47, 48, 49, 50, 51, 52, 25, 89, 36, 93, 26, 37, 33]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| MYM | 6OMR |
| ZMO | 3EJE |
| ZMQ | 3EJD |
| SXO | 2KGC 2KOS |
| 8Q1 | 5USR 5XTD 5XTB 6NZU 5WGB 6UXE 5XTC 5WLW 5XTI 5XTH 5WKP 6ODD |