Attributes
UniProt ID
Protein Name
Response regulator PleD
Ligand Name
9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one)
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PKFDLKSEZWEFGL-MHARETSRSA-N
SMILES
c1nc2c(n1C3C(C4C(O3)COP(=O)(OC5C(COP(=O)(O4)O)OC(C5O)n6cnc7c6N=C(NC7=O)N)O)O)N=C(NC2=O)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 1W25
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 atomse1w25A1e1w25A2e1w25A3e1w25B1e1w25B2e1w25B3
ECOD domains from experimental PDB structures interacting with ligand C2E
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q9A5I5 | n/a | C2E | 1w25 | e1w25A1 | A:294-455 |
| Q9A5I5 | n/a | C2E | 1w25 | e1w25A3 | A:141-293 |
| Q9A5I5 | n/a | C2E | 1w25 | e1w25B1 | B:294-455 |
| Q9A5I5 | n/a | C2E | 1w25 | e1w25B3 | B:141-293 |
| Q9A5I5 | n/a | C2E | 2v0n | e2v0nA1 | A:294-454 |
| Q9A5I5 | n/a | C2E | 2v0n | e2v0nB1 | B:294-454 |
| Q9A5I5 | n/a | C2E | 2wb4 | e2wb4A1 | A:294-459 |
| Q9A5I5 | n/a | C2E | 2wb4 | e2wb4A2 | A:2-140 |
| Q9A5I5 | n/a | C2E | 2wb4 | e2wb4A3 | A:141-293 |
| Q9A5I5 | n/a | C2E | 2wb4 | e2wb4B1 | B:294-454 |