Attributes
UniProt ID
Protein Name
Multifunctional 2-oxoglutarate metabolism enzyme
Ligand Name
2-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-2-[(1S)-1-oxidanylethyl]-1,3-thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WHPLAPKWYDKPQH-VIFPVBQESA-N
SMILES
Cc1c(sc([n+]1Cc2cnc(nc2N)C)C(C)O)CCOP(=O)(O)OP(=O)(O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3ZHV
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Color Legend
Unassigned regionsLigand / hetero atomse3zhvA3e3zhvA6e3zhvA7e3zhvB1e3zhvB2e3zhvB3e3zhvC1e3zhvC2e3zhvC3e3zhvD1e3zhvD4e3zhvD6
ECOD domains from experimental PDB structures interacting with ligand TDW
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0R2B1 | n/a | TDW | 3zhv | e3zhvA6 | A:365-814 |
| A0R2B1 | n/a | TDW | 3zhv | e3zhvA7 | A:831-1090 |
| A0R2B1 | n/a | TDW | 3zhv | e3zhvB1 | B:365-814 |
| A0R2B1 | n/a | TDW | 3zhv | e3zhvB2 | B:831-1090 |
| A0R2B1 | n/a | TDW | 3zhv | e3zhvC2 | C:816-1075 |
| A0R2B1 | n/a | TDW | 3zhv | e3zhvC3 | C:367-815 |
| A0R2B1 | n/a | TDW | 3zhv | e3zhvD4 | D:816-1075 |
| A0R2B1 | n/a | TDW | 3zhv | e3zhvD6 | D:366-815 |