Attributes
UniProt ID
Protein Name
Penicillin-binding protein 4
Ligand Name
(2R,4S)-2-[(1R)-1-{[(2R)-2-amino-2-phenylacetyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WHAIWIUXAXKSOT-NRWUCQMLSA-N
SMILES
CC1(C(NC(S1)C(C=O)NC(=O)C(c2ccccc2)N)C(=O)O)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3A3I
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Color Legend
Unassigned regionsLigand / hetero atomse3a3iA1e3a3iA2e3a3iA3e3a3iA4e3a3iB1e3a3iB2e3a3iB3e3a3iB4
ECOD domains from experimental PDB structures interacting with ligand AIX
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A8E0K8 | n/a | AIX | 3a3i | e3a3iA2 | A:65-86,A:297-366 |
| A8E0K8 | n/a | AIX | 3a3i | e3a3iA3 | A:27-64,A:367-479 |
| A8E0K8 | n/a | AIX | 3a3i | e3a3iA4 | A:87-177,A:254-296 |
| A8E0K8 | n/a | AIX | 3a3i | e3a3iB2 | B:65-86,B:297-366 |
| A8E0K8 | n/a | AIX | 3a3i | e3a3iB3 | B:27-64,B:367-479 |
| A8E0K8 | n/a | AIX | 3a3i | e3a3iB4 | B:87-177,B:254-296 |