Attributes
UniProt ID
Protein Name
beta-lactamase
Ligand Name
2-[(3S)-1-oxidanyl-3H-2,1-benzoxaborol-3-yl]prop-2-enoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BRBGRVSFRVLGNY-SECBINFHSA-N
SMILES
B1(c2ccccc2C(O1)C(=C)C(=O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 7E9A
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Color Legend
Unassigned regionsLigand / hetero atomse7e9aA1e7e9aA2e7e9aB1e7e9aB2e7e9aC1e7e9aC2e7e9aD1e7e9aD2
ECOD domains from experimental PDB structures interacting with ligand J00
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aA1 | A:25-66,A:181-291 |
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aA2 | A:67-180 |
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aB1 | B:67-180 |
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aB2 | B:28-66,B:181-291 |
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aC1 | C:25-66,C:181-291 |
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aC2 | C:67-180 |
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aD1 | D:25-66,D:181-291 |
| Q93LQ9 | n/a | J00 | 7e9a | e7e9aD2 | D:67-180 |