Attributes
UniProt ID
Protein Name
Aristolochene synthase
Ligand Name
S-[(2E,6E)-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENYL] TRIHYDROGEN THIODIPHOSPHATE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MYMLCRQRXFRQGP-YFVJMOTDSA-N
SMILES
CC(=CCCC(=CCCC(=CCSP(=O)(O)OP(=O)(O)O)C)C)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 4KUX
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Color Legend
Unassigned regionsLigand / hetero atomse4kuxA1e4kuxB1e4kuxC1e4kuxD1
ECOD domains from experimental PDB structures interacting with ligand DB04695
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q9UR08 | DB04695 | FPS | 4kux | e4kuxA1 | A:8-311 |
| Q9UR08 | DB04695 | FPS | 4kux | e4kuxB1 | B:8-311 |
| Q9UR08 | DB04695 | FPS | 4kux | e4kuxC1 | C:8-311 |
| Q9UR08 | DB04695 | FPS | 4kux | e4kuxD1 | D:8-311 |
| Q9UR08 | DB04695 | FPS | 5ivg | e5ivgA1 | A:8-312 |
| Q9UR08 | DB04695 | FPS | 5ivg | e5ivgB1 | B:8-311 |
| Q9UR08 | DB04695 | FPS | 5ivg | e5ivgC1 | C:8-311 |
| Q9UR08 | DB04695 | FPS | 5ivg | e5ivgD1 | D:8-312 |