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Attributes

UniProt ID
Protein Name
Cruzipain
Ligand Name
N-[(2S)-5-(carbamimidamidooxy)-1-oxo-1-{[(1E,3S)-5-phenyl-1-(pyrimidin-2-ylsulfonyl)pent-1-en-3-yl]amino}pentan-2-yl]-4-methylpiperazine-1-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FGWKPELIWHWYFZ-OBYRPWEKSA-N
SMILES
CN1CCN(CC1)C(=O)NC(CCCONC(=N)N)C(=O)NC(CCc2ccccc2)C=CS(=O)(=O)c3ncccn3
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4XUI
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Color Legend
Unassigned regionsLigand / hetero atomse4xuiA1e4xuiB1e4xuiC1
ECOD domains from experimental PDB structures interacting with ligand 2VC
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P25779n/a2VC4xuie4xuiA1A:1-215
P25779n/a2VC4xuie4xuiB1B:1-215
P25779n/a2VC4xuie4xuiC1C:1-215