DrugDomain logoDrugDomain

Attributes

UniProt ID
Q8Y9N5
Protein Name
Shikimate dehydrogenase
Ligand Name
NICOTINAMIDE-ADENINE-DINUCLEOTIDE
DrugBank ID
DB14128
PDB Ligand Accession
NAD
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

Interactive Mol* view for the current protein-molecule pair.

Mol*
Structure: 3TNL
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Color Legend
Unassigned regionsLigand / hetero atomse3tnlA1e3tnlA2e3tnlB1e3tnlB2e3tnlC1e3tnlC2e3tnlD1e3tnlD2
ECOD domains from experimental PDB structures interacting with ligand DB14128
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q8Y9N5DB14128NAD3tnle3tnlA1A:113-291
Q8Y9N5DB14128NAD3tnle3tnlA2A:4-112
Q8Y9N5DB14128NAD3tnle3tnlB1B:113-291
Q8Y9N5DB14128NAD3tnle3tnlB2B:3-112
Q8Y9N5DB14128NAD3tnle3tnlC1C:113-291
Q8Y9N5DB14128NAD3tnle3tnlC2C:3-112
Q8Y9N5DB14128NAD3tnle3tnlD1D:113-291
Q8Y9N5DB14128NAD3tnle3tnlD2D:4-112
Q8Y9N5DB14128NAD3toze3tozA1A:113-291
Q8Y9N5DB14128NAD3toze3tozB1B:113-291
Q8Y9N5DB14128NAD3toze3tozB2B:2-112
Q8Y9N5DB14128NAD3toze3tozC1C:113-291
Q8Y9N5DB14128NAD3toze3tozD1D:113-291
Q8Y9N5DB14128NAD3toze3tozE1E:113-291
Q8Y9N5DB14128NAD3toze3tozF1F:113-291
Q8Y9N5DB14128NAD3toze3tozG1G:113-291
Q8Y9N5DB14128NAD3toze3tozG2G:1-112
Q8Y9N5DB14128NAD3toze3tozH1H:113-291