Attributes
UniProt ID
Protein Name
Beta-lactamase
Ligand Name
(1R)-1-(2-THIENYLACETYLAMINO)-1-PHENYLMETHYLBORONIC ACID
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LGJCDEZMANATFA-ZDUSSCGKSA-N
SMILES
B(C(c1ccccc1)NC(=O)Cc2cccs2)(O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 1MY8
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Color Legend
Unassigned regionsLigand / hetero atomse1my8A1e1my8A2e1my8B1e1my8B2
ECOD domains from experimental PDB structures interacting with ligand DB08552
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P00811 | DB08552 | SM3 | 1my8 | e1my8A1 | A:60-223 |
| P00811 | DB08552 | SM3 | 1my8 | e1my8A2 | A:4-59,A:224-360 |
| P00811 | DB08552 | SM3 | 1my8 | e1my8B1 | B:60-223 |
| P00811 | DB08552 | SM3 | 1my8 | e1my8B2 | B:4-59,B:224-360 |
| P00811 | DB08552 | SM3 | 1pi4 | e1pi4A1 | A:60-223 |
| P00811 | DB08552 | SM3 | 1pi4 | e1pi4A2 | A:4-59,A:224-360 |
| P00811 | DB08552 | SM3 | 1pi4 | e1pi4B1 | B:60-223 |
| P00811 | DB08552 | SM3 | 1pi4 | e1pi4B2 | B:4-59,B:224-360 |
| P00811 | DB08552 | SM3 | 2ffy | e2ffyA1 | A:60-223 |
| P00811 | DB08552 | SM3 | 2ffy | e2ffyA2 | A:4-59,A:224-360 |
| P00811 | DB08552 | SM3 | 2ffy | e2ffyB1 | B:60-223 |
| P00811 | DB08552 | SM3 | 2ffy | e2ffyB2 | B:4-59,B:224-360 |