Attributes
UniProt ID
Protein Name
Sarcoplasmic/endoplasmic reticulum calcium ATPase 1 -ATPase 1) ATPase
Ligand Name
OCTANOIC ACID [3S-[3ALPHA, 3ABETA, 4ALPHA, 6BETA, 6ABETA, 7BETA, 8ALPHA(Z), 9BALPHA]]-6-(ACETYLOXY)-2,3,-3A,4,5,6,6A,7,8,9B-DECAHYDRO-3,3A-DIHYDROXY-3,6,9-TRIMETHYL-8-[(2-METHYL-1-OXO-2-BUTENYL)OX Y]-2-OXO-4-(1-OXOBUTOXY)-AZULENO[4,5-B]FURAN-7-YL ESTER
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IXFPJGBNCFXKPI-FSIHEZPISA-N
SMILES
CCCCCCCC(=O)OC1C2C(=C(C1OC(=O)C(=CC)C)C)C3C(C(CC2(C)OC(=O)C)OC(=O)CCC)(C(C(=O)O3)(C)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: 1IWO
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 atomse1iwoA1e1iwoA4e1iwoA5e1iwoA6e1iwoB1e1iwoB4e1iwoB5e1iwoB6
ECOD domains from experimental PDB structures interacting with ligand TG1
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P04191 | n/a | TG1 | 1iwo | e1iwoA6 | A:1-124,A:240-343,A:750-994 |
| P04191 | n/a | TG1 | 1iwo | e1iwoB6 | B:1-124,B:240-343,B:750-994 |
| P04191 | n/a | TG1 | 1wpg | e1wpgA6 | A:1-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 1wpg | e1wpgB6 | B:1-124,B:240-343,B:750-994 |
| P04191 | n/a | TG1 | 1wpg | e1wpgC6 | C:1-124,C:240-343,C:750-994 |
| P04191 | n/a | TG1 | 1wpg | e1wpgD6 | D:1-124,D:240-343,D:750-994 |
| P04191 | n/a | TG1 | 1xp5 | e1xp5A6 | A:1-124,A:240-343,A:750-994 |
| P04191 | n/a | TG1 | 2agv | e2agvA2 | A:1-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 2agv | e2agvB2 | B:1-124,B:240-343,B:751-994 |
| P04191 | n/a | TG1 | 2c88 | e2c88A2 | A:1-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 2c8k | e2c8kA2 | A:1-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 2c8l | e2c8lA2 | A:1-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 2dqs | e2dqsA2 | A:0-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 2ear | e2earA2 | A:0-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 2eat | e2eatA2 | A:0-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 2zbf | e2zbfA6 | A:0-124,A:240-343,A:750-994 |
| P04191 | n/a | TG1 | 2zbg | e2zbgA6 | A:0-124,A:240-343,A:750-994 |
| P04191 | n/a | TG1 | 3ar3 | e3ar3A2 | A:1A-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3ar4 | e3ar4A2 | A:1A-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3ar5 | e3ar5A2 | A:0-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3ar6 | e3ar6A2 | A:1A-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3ar7 | e3ar7A2 | A:0-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3ar8 | e3ar8A2 | A:1A-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3ar9 | e3ar9A2 | A:1A-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3n5k | e3n5kA2 | A:1-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 3n5k | e3n5kB2 | B:1-124,B:240-343,B:751-994 |
| P04191 | n/a | TG1 | 5a3q | e5a3qA4 | A:0-124,A:240-343,A:750-994 |
| P04191 | n/a | TG1 | 5a3s | e5a3sA3 | A:0-124,A:240-343,A:750-994 |
| P04191 | n/a | TG1 | 5a3s | e5a3sB1 | B:0-124,B:240-343,B:750-994 |
| P04191 | n/a | TG1 | 5xa9 | e5xa9A3 | A:0-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 5xaa | e5xaaA3 | A:0-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 5xab | e5xabA4 | A:0-124,A:240-343,A:750-994 |
| P04191 | n/a | TG1 | 5zmv | e5zmvA4 | A:-4-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 5zmw | e5zmwA3 | A:-5-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 6yso | e6ysoA2 | A:1-124,A:240-343,A:751-994 |
| P04191 | n/a | TG1 | 6yso | e6ysoB3 | B:1-124,B:240-343,B:751-991 |