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Attributes

UniProt ID
Protein Name
Diphtheria toxin --diphthamide ADP-ribosyltransferase
Ligand Name
NICOTINAMIDE-ADENINE-DINUCLEOTIDE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BAWFJGJZGIEFAR-NNYOXOHSSA-N
SMILES
c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 1TOX
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Color Legend
Unassigned regionsLigand / hetero atomse1toxA1e1toxA2e1toxA3e1toxB1e1toxB2e1toxB3
ECOD domains from experimental PDB structures interacting with ligand DB14128
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P00588DB14128NAD1toxe1toxA3A:1-187
P00588DB14128NAD1toxe1toxB3B:1-187