Attributes
UniProt ID
Protein Name
Dipeptidyl peptidase 4
Ligand Name
2-{4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]piperazin-1-yl}-N-(22-oxo-3,6,9,12,15,18-hexaoxa-21-azatricosan-1-yl)acetamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
UFCDLSMAWGWQEO-HHHXNRCGSA-N
SMILES
CC(=O)NCCOCCOCCOCCOCCOCCOCCNC(=O)CN1CCN(CC1)C(=O)CC(Cc2cc(c(cc2F)F)F)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 5VTA
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Color Legend
Unassigned regionsLigand / hetero atomse5vtaA1e5vtaA2e5vtaB1e5vtaB2e5vtaC1e5vtaC2e5vtaD1e5vtaD2e5vtaE1e5vtaE2e5vtaF1e5vtaF2e5vtaG1e5vtaH1e5vtaH2e5vtaI1e5vtaJ1e5vtaK1e5vtaL1e5vtaL2
ECOD domains from experimental PDB structures interacting with ligand 9K4
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P14740 | n/a | 9K4 | 5vta | e5vtaA1 | A:501-766 |
| P14740 | n/a | 9K4 | 5vta | e5vtaA2 | A:39-500 |
| P14740 | n/a | 9K4 | 5vta | e5vtaB1 | B:501-766 |
| P14740 | n/a | 9K4 | 5vta | e5vtaB2 | B:39-500 |
| P14740 | n/a | 9K4 | 5vta | e5vtaC1 | C:39-500 |
| P14740 | n/a | 9K4 | 5vta | e5vtaC2 | C:501-766 |
| P14740 | n/a | 9K4 | 5vta | e5vtaD1 | D:501-765 |
| P14740 | n/a | 9K4 | 5vta | e5vtaD2 | D:39-500 |