PDB ligand accession: CA
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: BHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES: [Ca+2]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Inorganic compounds
- Superclass: Homogeneous metal compounds
- Class: Homogeneous alkaline earth metal compounds
- Subclass: None
- Class: Homogeneous alkaline earth metal compounds
- Superclass: Homogeneous metal compounds
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 1BFD | Download | Experimental | e1bfdA3 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4GG1 | Download | Experimental | e4gg1A3 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JUA | Download | Experimental | e4juaA4 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JUD | Download | Experimental | e4judX4 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 3FSJ | Download | Experimental | e3fsjX3 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4K9M | Download | Experimental | e4k9mA2 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4MPJ | Download | Experimental | e4mpjA2 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4QEL | Download | Experimental | e4qelA3 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4GM4 | Download | Experimental | e4gm4A5 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4MQ5 | Download | Experimental | e4mq5A3 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4K9P | Download | Experimental | e4k9pA3 e4k9pB2 e4k9pC2 e4k9pD2 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JUC | Download | Experimental | e4jucA4 e4jucB3 e4jucC4 e4jucD4 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4GPE | Download | Experimental | e4gpeA5 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4MPR | Download | Experimental | e4mprA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JU9 | Download | Experimental | e4ju9A4 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1YNO | Download | Experimental | e1ynoA2 e1ynoA3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4GM1 | Download | Experimental | e4gm1A5 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4GM0 | Download | Experimental | e4gm0A5 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 2FWN | Download | Experimental | e2fwnA2 e2fwnA3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1PI3 | Download | Experimental | e1pi3A2 e1pi3A3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 5DGD | Download | Experimental | e5dgdA1 e5dgdA2 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JUF | Download | Experimental | e4jufA3 e4jufB2 e4jufC2 e4jufD2 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1Q6Z | Download | Experimental | e1q6zA2 e1q6zA3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JD5 | Download | Experimental | e4jd5A5 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4K9L | Download | Experimental | e4k9lA4 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4K9K | Download | Experimental | e4k9kA2 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4MZX | Download | Experimental | e4mzxA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 2FN3 | Download | Experimental | e2fn3A2 e2fn3A3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4K9O | Download | Experimental | e4k9oA3 e4k9oB2 e4k9oC2 e4k9oD2 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4MPP | Download | Experimental | e4mppA2 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 5DGT | Download | Experimental | e5dgtA1 e5dgtA3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JU8 | Download | Experimental | e4ju8A4 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4JUB | Download | Experimental | e4jubA4 e4jubB4 e4jubC4 e4jubD4 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 5DEI | Download | Experimental | e5deiA1 e5deiB3 e5deiC2 e5deiC3 e5deiD3 | Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 4GP9 | Download | Experimental | e4gp9A4 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
| 1PO7 | Download | Experimental | e1po7A2 e1po7A3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |