Attributes
UniProt ID
Protein Name
Pyruvate kinase PKLR
Ligand Name
N-({4-[(3,4-dihydroxyphenyl)methyl]phenyl}methyl)-3,4-dihydroxybenzene-1-sulfonamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WNFFMCJBFDREPV-UHFFFAOYSA-N
SMILES
c1cc(ccc1Cc2ccc(c(c2)O)O)CNS(=O)(=O)c3ccc(c(c3)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: 7FSB
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse7fsbA1e7fsbA2e7fsbB1e7fsbB2e7fsbC1e7fsbC2e7fsbD1e7fsbD2e7fsbE1e7fsbE2e7fsbF1e7fsbF2e7fsbG1e7fsbG2e7fsbH1e7fsbH2
ECOD domains from experimental PDB structures interacting with ligand OE0
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P30613 | n/a | OE0 | 7fsb | e7fsbA1 | A:23-408 |
| P30613 | n/a | OE0 | 7fsb | e7fsbA2 | A:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbB1 | B:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbB2 | B:10-408 |
| P30613 | n/a | OE0 | 7fsb | e7fsbC1 | C:19-408 |
| P30613 | n/a | OE0 | 7fsb | e7fsbC2 | C:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbD1 | D:21-408 |
| P30613 | n/a | OE0 | 7fsb | e7fsbD2 | D:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbE1 | E:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbE2 | E:23-408 |
| P30613 | n/a | OE0 | 7fsb | e7fsbF1 | F:11-408 |
| P30613 | n/a | OE0 | 7fsb | e7fsbF2 | F:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbG1 | G:23-408 |
| P30613 | n/a | OE0 | 7fsb | e7fsbG2 | G:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbH1 | H:409-543 |
| P30613 | n/a | OE0 | 7fsb | e7fsbH2 | H:21-408 |