DrugDomain logoDrugDomain

Attributes

UniProt ID
Q99538
Protein Name
Legumain
Ligand Name
N-[(2R)-4-amino-1-imino-4-oxobutan-2-yl]-1-(1-{4-[(2,4-difluorophenyl)methoxy]phenyl}cyclopropane-1-carbonyl)-L-prolinamide
DrugBank ID
None
PDB Ligand Accession
WSN
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
UTRUAJSKSGNHPD-DIJIZMSBSA-N
SMILES
c1cc(ccc1C2(CC2)C(=O)N3CCCC3C(=O)NC(CC(=O)N)C=N)OCc4ccc(cc4F)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Mol*
Structure: 7FQI
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Color Legend
Unassigned regionsLigand / hetero atomse7fqiA1e7fqiB1e7fqiC1
ECOD domains from experimental PDB structures interacting with ligand WSN
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q99538n/aWSN7fqie7fqiA1A:26-290
Q99538n/aWSN7fqie7fqiB1B:26-289
Q99538n/aWSN7fqie7fqiC1C:27-287
Q99538n/aWSN7fqje7fqjA1A:26-290
Q99538n/aWSN7fqje7fqjB1B:26-289
Q99538n/aWSN7fqje7fqjC1C:27-286
Q99538n/aWSN7fqle7fqlA1A:27-286
Q99538n/aWSN7fqle7fqlB1B:26-290
Q99538n/aWSN7fqle7fqlC1C:27-287
Q99538n/aWSN7fqle7fqlD1D:27-286
Q99538n/aWSN7fqle7fqlE1E:27-290
Q99538n/aWSN7fqle7fqlF1F:27-286
Q99538n/aWSN7fqle7fqlG1G:27-286
Q99538n/aWSN7fqle7fqlH1H:27-286