Attributes
UniProt ID
Protein Name
Trypanothione reductase ,N-bisspermidine reductase
Ligand Name
~{N}-[2-(4-fluorophenyl)ethyl]furan-2-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
GSMVTQDRELNXRQ-UHFFFAOYSA-N
SMILES
c1cc(oc1)C(=O)NCCc2ccc(cc2)F
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5S9W
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Color Legend
Unassigned regionsLigand / hetero atomse5s9wA1e5s9wA2e5s9wA3e5s9wB1e5s9wB2e5s9wB3
ECOD domains from experimental PDB structures interacting with ligand N08
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A3L6KZJ1 | n/a | N08 | 5s9w | e5s9wA1 | A:358-488 |
| A0A3L6KZJ1 | n/a | N08 | 5s9w | e5s9wA3 | A:3-168,A:286-357 |
| A0A3L6KZJ1 | n/a | N08 | 5s9w | e5s9wB2 | B:358-485 |
| A0A3L6KZJ1 | n/a | N08 | 5s9w | e5s9wB3 | B:3-168,B:286-357 |