Attributes
UniProt ID
Protein Name
Flavin-dependent halogenase malA
Ligand Name
(5aS,12aS,13aS)-12,12-dimethyl-2,3,11,12,12a,13-hexahydro-1H,5H,6H-5a,13a-(epiminomethano)indolizino[7,6-b]carbazol-14-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LBTZXCFDJFHPMI-DQLDELGASA-N
SMILES
CC1(c2c(c3ccccc3[nH]2)CC45C1CC6(CCCN6C4)C(=O)N5)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 5WGR
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 atomse5wgrA1e5wgrA2e5wgrA3
ECOD domains from experimental PDB structures interacting with ligand PM7
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| L0E155 | n/a | PM7 | 5wgr | e5wgrA1 | A:3-222,A:383-585 |
| L0E155 | n/a | PM7 | 5wgr | e5wgrA3 | A:586-666 |
| L0E155 | n/a | PM7 | 5wgs | e5wgsA1 | A:586-666 |
| L0E155 | n/a | PM7 | 5wgs | e5wgsA2 | A:3-222,A:383-585 |
| L0E155 | n/a | PM7 | 5wgt | e5wgtA2 | A:586-666 |
| L0E155 | n/a | PM7 | 5wgt | e5wgtA3 | A:3-222,A:383-585 |
| L0E155 | n/a | PM7 | 5wgu | e5wguA2 | A:3-222,A:383-585 |
| L0E155 | n/a | PM7 | 5wgu | e5wguA3 | A:586-666 |
| L0E155 | n/a | PM7 | 5wgv | e5wgvA1 | A:3-222,A:383-585 |
| L0E155 | n/a | PM7 | 5wgv | e5wgvA3 | A:586-666 |