Attributes
UniProt ID
Protein Name
Beta-lactamase
Ligand Name
(4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
DYQHXZPAIVAJRU-HTXLXMOSSA-N
SMILES
CC1C(NC(=C1SC2CC(NC2)C(=O)N(C)C)C(=O)O)C(C=O)C(C)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 6PT1
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Color Legend
Unassigned regionsLigand / hetero atomse6pt1A1e6pt1A2e6pt1B1e6pt1B2e6pt1C1e6pt1C2e6pt1D1e6pt1D2
ECOD domains from experimental PDB structures interacting with ligand MER
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1A1 | A:63-163 |
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1A2 | A:19-64,A:162-265 |
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1B1 | B:22-64,B:162-265 |
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1B2 | B:63-163 |
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1C1 | C:63-163 |
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1C2 | C:19-64,C:162-265 |
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1D1 | D:22-64,D:162-265 |
| A0A482LRD5 | n/a | MER | 6pt1 | e6pt1D2 | D:63-163 |