Attributes
UniProt ID
Protein Name
1-deoxy-D-xylulose-5-phosphate synthase
Ligand Name
THIAMINE DIPHOSPHATE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
AYEKOFBPNLCAJY-UHFFFAOYSA-O
SMILES
Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)OP(=O)(O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 8A5K
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Color Legend
Unassigned regionsLigand / hetero atomse8a5kA1e8a5kA2e8a5kA3e8a5kB1e8a5kB2e8a5kB3e8a5kC1e8a5kC2e8a5kC3e8a5kD1e8a5kD2e8a5kD3e8a5kE1e8a5kE2e8a5kE3e8a5kF1e8a5kF2e8a5kF3
ECOD domains from experimental PDB structures interacting with ligand TPP
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| B7V7R4 | n/a | TPP | 8a5k | e8a5kA1 | A:33-315 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kA2 | A:316-487 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kB2 | B:316-487 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kB3 | B:34-315 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kC1 | C:34-315 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kC2 | C:316-487 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kD1 | D:316-487 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kD2 | D:32-315 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kE1 | E:316-487 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kE3 | E:33-315 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kF1 | F:38-293 |
| B7V7R4 | n/a | TPP | 8a5k | e8a5kF2 | F:319-490 |