PDB ligand accession: TPP
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: AYEKOFBPNLCAJY-UHFFFAOYSA-O
SMILES: Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)OP(=O)(O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrimidines and pyrimidine derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 2BFE | Download | Experimental | e2bfeA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1OLU | Download | Experimental | e1oluA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1OLS | Download | Experimental | e1olsA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1V1M | Download | Experimental | e1v1mA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 2BFD | Download | Experimental | e2bfdA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1X7Z | Download | Experimental | e1x7zA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1DTW | Download | Experimental | e1dtwA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1X7W | Download | Experimental | e1x7wA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1X7X | Download | Experimental | e1x7xA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1X80 | Download | Experimental | e1x80A1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1U5B | Download | Experimental | e1u5bA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1V11 | Download | Experimental | e1v11A1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1X7Y | Download | Experimental | e1x7yA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1V16 | Download | Experimental | e1v16A1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 2BFB | Download | Experimental | e2bfbA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1OLX | Download | Experimental | e1olxA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |