Attributes
UniProt ID
Protein Name
Thiamine-binding periplasmic protein
Ligand Name
THIAMIN PHOSPHATE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
HZSAJDVWZRBGIF-UHFFFAOYSA-O
SMILES
Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 2QRY
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Color Legend
Unassigned regionsLigand / hetero atomse2qryA1e2qryA2e2qryB1e2qryB2e2qryC1e2qryC2e2qryD1e2qryD2
ECOD domains from experimental PDB structures interacting with ligand DB03416
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P31550 | DB03416 | TPS | 2qry | e2qryA1 | A:19-128,A:244-286 |
| P31550 | DB03416 | TPS | 2qry | e2qryA2 | A:129-243,A:287-326 |
| P31550 | DB03416 | TPS | 2qry | e2qryB1 | B:129-243 |
| P31550 | DB03416 | TPS | 2qry | e2qryB2 | B:19-128,B:244-327 |
| P31550 | DB03416 | TPS | 2qry | e2qryC1 | C:129-243 |
| P31550 | DB03416 | TPS | 2qry | e2qryC2 | C:19-128,C:244-327 |
| P31550 | DB03416 | TPS | 2qry | e2qryD1 | D:19-128,D:244-286 |
| P31550 | DB03416 | TPS | 2qry | e2qryD2 | D:129-243,D:287-327 |