Attributes
UniProt ID
Protein Name
Trypanothione reductase ,N-bisspermidine reductase
Ligand Name
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,3,4-thiadiazol-2(3H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
QMZRSGJUZDOFDN-UHFFFAOYSA-N
SMILES
Cc1c(c(on1)C)CN2C(=O)SC(=N2)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5S9X
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Color Legend
Unassigned regionsLigand / hetero atomse5s9xA1e5s9xA2e5s9xA3e5s9xB1e5s9xB2e5s9xB3
ECOD domains from experimental PDB structures interacting with ligand K1A
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A3L6KZJ1 | n/a | K1A | 5s9x | e5s9xA1 | A:3-168,A:286-357 |
| A0A3L6KZJ1 | n/a | K1A | 5s9x | e5s9xB1 | B:169-285 |
| A0A3L6KZJ1 | n/a | K1A | 5s9x | e5s9xB2 | B:358-485 |
| A0A3L6KZJ1 | n/a | K1A | 5s9x | e5s9xB3 | B:3-168,B:286-357 |