Attributes
UniProt ID
Protein Name
ActII protein
Ligand Name
2,2'-[(1R,1'R,3S,3'S)-6,6',9,9'-tetrahydroxy-1,1'-dimethyl-5,5',10,10'-tetraoxo-3,3',4,4',5,5',10,10'-octahydro-1H,1'H-8,8'-bibenzo[g]isochromene-3,3'-diyl]diacetic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VTIKDEXOEJDMJP-WYUUTHIRSA-N
SMILES
CC1C2=C(CC(O1)CC(=O)O)C(=O)c3c(cc(c(c3C2=O)O)c4cc(c5c(c4O)C(=O)C6=C(C5=O)CC(OC6C)CC(=O)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: 3B6A
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Color Legend
Unassigned regionsLigand / hetero atomse3b6aA1e3b6aA2e3b6aB3e3b6aB4e3b6aC1e3b6aC2e3b6aD1e3b6aD2e3b6aE1e3b6aE2e3b6aF1e3b6aF2e3b6aG1e3b6aG2e3b6aH3e3b6aH4
ECOD domains from experimental PDB structures interacting with ligand ZCT
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q53901 | n/a | ZCT | 3b6a | e3b6aA1 | A:28-93 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aA2 | A:94-245 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aB3 | B:29-92 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aB4 | B:93-243 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aC1 | C:28-93 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aC2 | C:94-245 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aD1 | D:29-93 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aD2 | D:94-243 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aE1 | E:28-93 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aE2 | E:94-245 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aF1 | F:29-93 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aF2 | F:94-243 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aG1 | G:28-93 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aG2 | G:94-245 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aH3 | H:29-92 |
| Q53901 | n/a | ZCT | 3b6a | e3b6aH4 | H:93-243 |