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Attributes

UniProt ID
Protein Name
Coagulation factor XII
Ligand Name
(2S)-4-(5-chloro-1,3-benzoxazol-2-yl)-1-(N,3-dicyclohexyl-D-alanyl)-N-[(thiophen-2-yl)methyl]piperazine-2-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WQMFHHFJPDQBMH-IZLXSDGUSA-N
SMILES
c1cc(sc1)CNC(=O)C2CN(CCN2C(=O)C(CC3CCCCC3)NC4CCCCC4)c5nc6cc(ccc6o5)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 6X0S
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Color Legend
Unassigned regionsLigand / hetero atomse6x0sA1e6x0sB1e6x0sC1
ECOD domains from experimental PDB structures interacting with ligand UJA
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P00748n/aUJA6x0se6x0sA1A:357-614
P00748n/aUJA6x0se6x0sB1B:358-614
P00748n/aUJA6x0se6x0sC1C:358-614