Attributes
UniProt ID
Protein Name
12-epi-hapalindole U synthase
Ligand Name
4-(1~{H}-indol-3-yl)butan-2-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZJCUUXGLZWBCIL-UHFFFAOYSA-N
SMILES
CC(=O)CCc1c[nH]c2c1cccc2
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5ZFJ
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Color Legend
Unassigned regionsLigand / hetero atomse5zfjA1e5zfjB1e5zfjC1e5zfjD1
ECOD domains from experimental PDB structures interacting with ligand 9BF
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A1P8VSI6 | n/a | 9BF | 5zfj | e5zfjA1 | A:27-225 |
| A0A1P8VSI6 | n/a | 9BF | 5zfj | e5zfjB1 | B:27-225 |
| A0A1P8VSI6 | n/a | 9BF | 5zfj | e5zfjC1 | C:27-225 |
| A0A1P8VSI6 | n/a | 9BF | 5zfj | e5zfjD1 | D:27-225 |