Attributes
UniProt ID
Protein Name
Carbapenem-hydrolyzing beta-lactamase KPC-2
Ligand Name
(2R)-2-[(2S,3R)-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]-4-(2-methanimidamidoethylsulfanyl)-2,3-dihydro-1H-pyrrole -5-carboxylic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KSLAOLVLEKIZMQ-ZXFLCMHBSA-N
SMILES
CC(C(C1CC(=C(N1)C(=O)O)SCCNC=N)C(=O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 6XJ8
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Color Legend
Unassigned regionsLigand / hetero atomse6xj8A1e6xj8A2
ECOD domains from experimental PDB structures interacting with ligand 8YF
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q9F663 | n/a | 8YF | 6xj8 | e6xj8A1 | A:26-65,A:180-292 |
| Q9F663 | n/a | 8YF | 6xj8 | e6xj8A2 | A:66-179 |
| Q9F663 | n/a | 8YF | 7lnl | e7lnlA1 | A:26-65,A:180-291 |
| Q9F663 | n/a | 8YF | 7lnl | e7lnlA2 | A:66-179 |
| Q9F663 | n/a | 8YF | 7lnl | e7lnlB1 | B:66-179 |
| Q9F663 | n/a | 8YF | 7lnl | e7lnlB2 | B:26-65,B:180-291 |
| Q9F663 | n/a | 8YF | 7lr9 | e7lr9A1 | A:66-179 |
| Q9F663 | n/a | 8YF | 7lr9 | e7lr9A2 | A:26-65,A:180-291 |
| Q9F663 | n/a | 8YF | 7lr9 | e7lr9B1 | B:66-179 |
| Q9F663 | n/a | 8YF | 7lr9 | e7lr9B2 | B:26-65,B:180-291 |