Attributes
UniProt ID
Protein Name
Secreted hydrolase
Ligand Name
methyl (2E)-3-[(1aS,11S,11aS,14Z,18R)-3,18-dihydroxy-4,9-dioxo-4,9,10,11-tetrahydro-11aH-11,1a-hept[3]ene[1,5]diynonaphtho[2,3-h]oxireno[c]quinolin-11a-yl]but-2-enoate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VNWTWPJYWHYMNF-PUHZCEAISA-N
SMILES
CC(=CC(=O)OC)C12C3C#CC=CC#CC(C1(O2)c4cc(c5c(c4N3)C(=O)c6ccccc6C5=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: 8G5U
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Color Legend
Unassigned regionsLigand / hetero atomse8g5uA1e8g5uB1e8g5uC1e8g5uD1
ECOD domains from experimental PDB structures interacting with ligand 9VG
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A125SA15 | n/a | 9VG | 8g5u | e8g5uA1 | A:8-488 |
| A0A125SA15 | n/a | 9VG | 8g5u | e8g5uB1 | B:8-488 |
| A0A125SA15 | n/a | 9VG | 8g5u | e8g5uC1 | C:8-488 |
| A0A125SA15 | n/a | 9VG | 8g5u | e8g5uD1 | D:8-488 |