Attributes
UniProt ID
Protein Name
Homospermidine synthase
Ligand Name
3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
REEBJQTUIJTGAL-UHFFFAOYSA-N
SMILES
c1cc[n+](cc1)CCCS(=O)(=O)[O-]
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4TVB
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Color Legend
Unassigned regionsLigand / hetero atomse4tvbA1e4tvbA2e4tvbB1
ECOD domains from experimental PDB structures interacting with ligand 1PS
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| O32323 | n/a | 1PS | 4tvb | e4tvbA1 | A:3-160,A:391-477 |
| O32323 | n/a | 1PS | 4tvb | e4tvbA2 | A:161-390 |
| O32323 | n/a | 1PS | 4xqc | e4xqcA1 | A:3-477 |
| O32323 | n/a | 1PS | 4xqc | e4xqcB1 | B:3-477 |
| O32323 | n/a | 1PS | 4xqe | e4xqeA1 | A:3-476 |
| O32323 | n/a | 1PS | 4xqe | e4xqeB1 | B:3-476 |
| O32323 | n/a | 1PS | 4xqg | e4xqgA1 | A:3-476 |
| O32323 | n/a | 1PS | 4xqg | e4xqgB1 | B:3-477 |
| O32323 | n/a | 1PS | 4xr4 | e4xr4A1 | A:3-476 |
| O32323 | n/a | 1PS | 4xr4 | e4xr4B1 | B:3-476 |
| O32323 | n/a | 1PS | 4xrg | e4xrgA1 | A:3-476 |
| O32323 | n/a | 1PS | 4xrg | e4xrgB1 | B:3-476 |
| O32323 | n/a | 1PS | 6s4d | e6s4dA1 | A:3-477 |
| O32323 | n/a | 1PS | 6s4d | e6s4dB1 | B:3-477 |
| O32323 | n/a | 1PS | 6s6g | e6s6gB1 | B:2-476 |