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Attributes

UniProt ID
Protein Name
Adenosine 5'-monophosphoramidase HINT1
Ligand Name
5'-deoxy-5'-[({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}sulfamoyl)amino]adenosine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RSZBCKJLQVSFKT-RHCAYAJFSA-N
SMILES
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CNS(=O)(=O)NC(=O)CCCCC4C5C(CS4)NC(=O)N5)O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5I2F
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Color Legend
Unassigned regionsLigand / hetero atomse5i2fA1e5i2fB1
ECOD domains from experimental PDB structures interacting with ligand BS5
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P49773n/aBS55i2fe5i2fA1A:11-126
P49773n/aBS55i2fe5i2fB1B:15-126