Attributes
UniProt ID
Protein Name
S-malonyltransferase
Ligand Name
N-[2-(acetylamino)ethyl]-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
GTANJSAWPNEGPZ-NSHDSACASA-N
SMILES
CC(=O)NCCNC(=O)CCNC(=O)C(C(C)(C)COP(=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: 7F2R
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 atomse7f2rA1e7f2rA2e7f2rB1e7f2rC1e7f2rC2e7f2rD1
ECOD domains from experimental PDB structures interacting with ligand 9EF
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q76KY5 | n/a | 9EF | 7f2r | e7f2rA1 | A:18-140,A:213-320 |
| Q76KY5 | n/a | 9EF | 7f2r | e7f2rA2 | A:141-214 |
| Q76KY5 | n/a | 9EF | 7f2r | e7f2rC1 | C:18-140,C:213-320 |
| Q76KY5 | n/a | 9EF | 7f2r | e7f2rC2 | C:141-214 |
| Q76KY5 | n/a | 9EF | 8h6s | e8h6sA1 | A:16-148,A:213-321 |
| Q76KY5 | n/a | 9EF | 8h6s | e8h6sA2 | A:149-212 |
| Q76KY5 | n/a | 9EF | 8h6s | e8h6sB1 | B:149-212 |
| Q76KY5 | n/a | 9EF | 8h6s | e8h6sB2 | B:19-148,B:213-318 |