DrugDomain logoDrugDomain

Attributes

UniProt ID
P00352
Protein Name
Aldehyde dehydrogenase 1A1
Ligand Name
1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE
DrugBank ID
DB00157
PDB Ligand Accession
NAI
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BOPGDPNILDQYTO-NNYOXOHSSA-N
SMILES
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=CCC(=C5)C(=O)N)O)O)O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Mol*
Structure: 4WB9
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Color Legend
Unassigned regionsLigand / hetero atomse4wb9A1e4wb9A2
ECOD domains from experimental PDB structures interacting with ligand DB00157
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P00352DB00157NAI4wb9e4wb9A1A:9-271
P00352DB00157NAI4wb9e4wb9A2A:272-501
P00352DB00157NAI4x4le4x4lA1A:9-271
P00352DB00157NAI4x4le4x4lA2A:272-501
P00352DB00157NAI5teie5teiA1A:9-271
P00352DB00157NAI5teie5teiA2A:272-501
P00352DB00157NAI8wfqe8wfqA1A:8-271
P00352DB00157NAI8wfqe8wfqA2A:272-501
P00352DB00157NAI8wfqe8wfqB1B:8-271
P00352DB00157NAI8wfqe8wfqB2B:272-501
P00352DB00157NAI8wfqe8wfqC1C:272-501
P00352DB00157NAI8wfqe8wfqC2C:8-271
P00352DB00157NAI8wfqe8wfqD1D:272-501
P00352DB00157NAI8wfqe8wfqD2D:8-271
P00352DB00157NAI8wfqe8wfqE1E:8-271
P00352DB00157NAI8wfqe8wfqE2E:272-501
P00352DB00157NAI8wfqe8wfqF1F:9-271
P00352DB00157NAI8wfqe8wfqF2F:272-501
P00352DB00157NAI8wfqe8wfqG1G:272-501
P00352DB00157NAI8wfqe8wfqG2G:8-271
P00352DB00157NAI8wfqe8wfqH1H:272-501
P00352DB00157NAI8wfqe8wfqH2H:9-271