Attributes
UniProt ID
Protein Name
Pinosylvin synthase
Ligand Name
3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RSTKLPZEZYGQPY-UHFFFAOYSA-N
SMILES
c1ccc2c(c1)c(c[nH]2)CC(=O)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 1XES
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Color Legend
Unassigned regionsLigand / hetero atomse1xesA1e1xesA2e1xesB1e1xesB2e1xesC1e1xesC2e1xesD1e1xesD2
ECOD domains from experimental PDB structures interacting with ligand 3IO
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q02323 | n/a | 3IO | 1xes | e1xesA1 | A:6-233 |
| Q02323 | n/a | 3IO | 1xes | e1xesA2 | A:234-392 |
| Q02323 | n/a | 3IO | 1xes | e1xesB1 | B:6-233 |
| Q02323 | n/a | 3IO | 1xes | e1xesB2 | B:234-392 |
| Q02323 | n/a | 3IO | 1xes | e1xesC1 | C:6-233 |
| Q02323 | n/a | 3IO | 1xes | e1xesC2 | C:234-392 |
| Q02323 | n/a | 3IO | 1xes | e1xesD1 | D:6-238 |
| Q02323 | n/a | 3IO | 1xes | e1xesD2 | D:239-393 |
| Q02323 | n/a | 3IO | 1xet | e1xetA1 | A:6-233 |
| Q02323 | n/a | 3IO | 1xet | e1xetB1 | B:6-233 |
| Q02323 | n/a | 3IO | 1xet | e1xetB2 | B:234-392 |
| Q02323 | n/a | 3IO | 1xet | e1xetC1 | C:4-238 |
| Q02323 | n/a | 3IO | 1xet | e1xetC2 | C:239-392 |
| Q02323 | n/a | 3IO | 1xet | e1xetD1 | D:6-238 |
| Q02323 | n/a | 3IO | 1xet | e1xetD2 | D:239-393 |