Attributes
UniProt ID
Protein Name
Diguanylate phosphodiesterase
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
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Structure: 3GFX
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Color Legend
Unassigned regionsLigand / hetero atomse3gfxA3e3gfxA4e3gfxB3e3gfxB4
ECOD domains from experimental PDB structures interacting with ligand C2E
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A6T8V8 | n/a | C2E | 3gfx | e3gfxA3 | A:158-399 |
| A6T8V8 | n/a | C2E | 3gfx | e3gfxB3 | B:158-400 |
| A6T8V8 | n/a | C2E | 3gfy | e3gfyA1 | A:158-400 |
| A6T8V8 | n/a | C2E | 3gfy | e3gfyB3 | B:158-400 |
| A6T8V8 | n/a | C2E | 3gfz | e3gfzA2 | A:154-400 |
| A6T8V8 | n/a | C2E | 3gfz | e3gfzB3 | B:158-400 |
| A6T8V8 | n/a | C2E | 3gg0 | e3gg0A3 | A:158-400 |
| A6T8V8 | n/a | C2E | 3gg0 | e3gg0B3 | B:158-400 |
| A6T8V8 | n/a | C2E | 3gg1 | e3gg1A3 | A:158-399 |
| A6T8V8 | n/a | C2E | 3gg1 | e3gg1B3 | B:158-400 |