Attributes
UniProt ID
Protein Name
Oxalyl-CoA decarboxylase
Ligand Name
2-{4-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-3-METHYLTHIOPHEN-2-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IOGGWTLVIZLGGZ-UHFFFAOYSA-N
SMILES
Cc1c(csc1CCOP(=O)(O)OP(=O)(O)O)Cc2cnc(nc2N)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 2JI6
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Color Legend
Unassigned regionsLigand / hetero atomse2ji6A1e2ji6A2e2ji6A3e2ji6B1e2ji6B2e2ji6B3
ECOD domains from experimental PDB structures interacting with ligand TPW
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P40149 | n/a | TPW | 2ji6 | e2ji6A2 | A:7-194 |
| P40149 | n/a | TPW | 2ji6 | e2ji6A3 | A:370-552 |
| P40149 | n/a | TPW | 2ji6 | e2ji6B2 | B:7-194 |
| P40149 | n/a | TPW | 2ji6 | e2ji6B3 | B:370-552 |
| P40149 | n/a | TPW | 2ji9 | e2ji9A2 | A:7-194 |
| P40149 | n/a | TPW | 2ji9 | e2ji9A3 | A:370-552 |
| P40149 | n/a | TPW | 2ji9 | e2ji9B2 | B:7-194 |
| P40149 | n/a | TPW | 2ji9 | e2ji9B3 | B:370-552 |