Attributes
UniProt ID
Protein Name
Pyruvate kinase PKLR
Ligand Name
3,4-dihydroxy-N-{[4-(3-hydroxybenzene-1-sulfonyl)phenyl]methyl}benzene-1-sulfonamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VUAKJQMZHVAFHX-UHFFFAOYSA-N
SMILES
c1cc(cc(c1)S(=O)(=O)c2ccc(cc2)CNS(=O)(=O)c3ccc(c(c3)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: 7FRZ
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Color Legend
Unassigned regionsLigand / hetero atomse7frzA1e7frzA2e7frzB1e7frzB2e7frzC1e7frzC2e7frzD1e7frzD2e7frzE1e7frzE2e7frzF1e7frzF2e7frzG1e7frzG2e7frzH1e7frzH2
ECOD domains from experimental PDB structures interacting with ligand O99
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P30613 | n/a | O99 | 7frz | e7frzA1 | A:23-408 |
| P30613 | n/a | O99 | 7frz | e7frzA2 | A:409-543 |
| P30613 | n/a | O99 | 7frz | e7frzB1 | B:409-543 |
| P30613 | n/a | O99 | 7frz | e7frzB2 | B:10-408 |
| P30613 | n/a | O99 | 7frz | e7frzC1 | C:409-543 |
| P30613 | n/a | O99 | 7frz | e7frzC2 | C:19-408 |
| P30613 | n/a | O99 | 7frz | e7frzD1 | D:21-408 |
| P30613 | n/a | O99 | 7frz | e7frzD2 | D:409-543 |
| P30613 | n/a | O99 | 7frz | e7frzE1 | E:409-543 |
| P30613 | n/a | O99 | 7frz | e7frzE2 | E:23-408 |
| P30613 | n/a | O99 | 7frz | e7frzF1 | F:409-543 |
| P30613 | n/a | O99 | 7frz | e7frzF2 | F:11-408 |
| P30613 | n/a | O99 | 7frz | e7frzG1 | G:23-408 |
| P30613 | n/a | O99 | 7frz | e7frzG2 | G:409-543 |
| P30613 | n/a | O99 | 7frz | e7frzH1 | H:21-408 |
| P30613 | n/a | O99 | 7frz | e7frzH2 | H:409-543 |