Attributes
UniProt ID
Protein Name
beta-lactamase
Ligand Name
[(1R)-1-[[(2S)-2-methyl-3-sulfanyl-propanoyl]amino]-2-phenyl-ethyl]boronic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FYDJFEUAPCQUQY-KOLCDFICSA-N
SMILES
B(C(Cc1ccccc1)NC(=O)C(C)CS)(O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 6JN3
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Color Legend
Unassigned regionsLigand / hetero atomse6jn3A1e6jn3A2e6jn3B1e6jn3B2e6jn3C1e6jn3C2e6jn3D1e6jn3D2
ECOD domains from experimental PDB structures interacting with ligand BX6
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3A1 | A:25-65,A:180-291 |
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3A2 | A:66-179 |
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3B1 | B:26-65,B:180-291 |
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3B2 | B:66-179 |
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3C1 | C:25-65,C:180-291 |
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3C2 | C:66-179 |
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3D1 | D:30-65,D:180-291 |
| Q93LQ9 | n/a | BX6 | 6jn3 | e6jn3D2 | D:66-179 |