Attributes
UniProt ID
Protein Name
Pyruvate kinase PKLR
Ligand Name
(1M)-N-({4-[(3,4-dihydroxyphenyl)methyl]phenyl}methyl)-3',4,4',5-tetrahydroxy[1,1'-biphenyl]-2-sulfonamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MJBOUCYGTWUCAO-UHFFFAOYSA-N
SMILES
c1cc(ccc1Cc2ccc(c(c2)O)O)CNS(=O)(=O)c3cc(c(cc3c4ccc(c(c4)O)O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 7FSD
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Color Legend
Unassigned regionsLigand / hetero atomse7fsdA1e7fsdA2e7fsdB1e7fsdB2e7fsdC1e7fsdC2e7fsdD1e7fsdD2e7fsdE1e7fsdE2e7fsdF1e7fsdF2e7fsdG1e7fsdG2e7fsdH1e7fsdH2
ECOD domains from experimental PDB structures interacting with ligand OD9
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P30613 | n/a | OD9 | 7fsd | e7fsdA1 | A:409-543 |
| P30613 | n/a | OD9 | 7fsd | e7fsdA2 | A:23-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdB1 | B:10-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdB2 | B:409-543 |
| P30613 | n/a | OD9 | 7fsd | e7fsdC1 | C:409-543 |
| P30613 | n/a | OD9 | 7fsd | e7fsdC2 | C:19-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdD1 | D:409-543 |
| P30613 | n/a | OD9 | 7fsd | e7fsdD2 | D:21-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdE1 | E:409-543 |
| P30613 | n/a | OD9 | 7fsd | e7fsdE2 | E:23-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdF1 | F:409-543 |
| P30613 | n/a | OD9 | 7fsd | e7fsdF2 | F:11-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdG1 | G:23-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdG2 | G:409-543 |
| P30613 | n/a | OD9 | 7fsd | e7fsdH1 | H:21-408 |
| P30613 | n/a | OD9 | 7fsd | e7fsdH2 | H:409-543 |