Attributes
UniProt ID
Protein Name
2-dehydropantoate 2-reductase
Ligand Name
2-oxidanylidene-2-phenylazanyl-ethanoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PQJZHMCWDKOPQG-UHFFFAOYSA-N
SMILES
c1ccc(cc1)NC(=O)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5X20
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Color Legend
Unassigned regionsLigand / hetero atomse5x20A1e5x20A2e5x20B1e5x20B2e5x20C1e5x20C2e5x20D1e5x20D2e5x20E1e5x20E2e5x20F1
ECOD domains from experimental PDB structures interacting with ligand AOT
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q3Y316 | n/a | AOT | 5x20 | e5x20A1 | A:163-312 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20A2 | A:1-162 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20B1 | B:163-311 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20B2 | B:1-162 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20C1 | C:1-162 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20C2 | C:163-312 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20D1 | D:163-311 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20D2 | D:7-35,D:73-162 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20E1 | E:1-162 |
| Q3Y316 | n/a | AOT | 5x20 | e5x20E2 | E:163-312 |