DrugDomain logoDrugDomain

Attributes

UniProt ID
P39051
Protein Name
Trypanothione reductase ,N-bisspermidine reductase
Ligand Name
FLAVIN-ADENINE DINUCLEOTIDE
DrugBank ID
DB03147
PDB Ligand Accession
FAD
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VWWQXMAJTJZDQX-UYBVJOGSSA-N
SMILES
Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)n5cnc6c5ncnc6N)O)O)O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Mol*
Structure: 2WBA
Open File
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse2wbaA1e2wbaA2e2wbaA3e2wbaB1e2wbaB2e2wbaB3
ECOD domains from experimental PDB structures interacting with ligand DB03147
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P39051DB03147FAD2wbae2wbaA1A:358-490
P39051DB03147FAD2wbae2wbaA2A:2-168,A:286-357
P39051DB03147FAD2wbae2wbaA3A:169-285
P39051DB03147FAD2wbae2wbaB1B:358-490
P39051DB03147FAD2wbae2wbaB2B:2-168,B:286-357
P39051DB03147FAD2wbae2wbaB3B:169-285
P39051DB03147FAD2wpfe2wpfA1A:358-488
P39051DB03147FAD2wpfe2wpfA2A:-1-168,A:286-357
P39051DB03147FAD2wpfe2wpfA3A:169-285
P39051DB03147FAD2wpfe2wpfB1B:358-488
P39051DB03147FAD2wpfe2wpfB2B:2-168,B:286-357
P39051DB03147FAD2wpfe2wpfB3B:169-285
P39051DB03147FAD2wpfe2wpfC1C:358-489
P39051DB03147FAD2wpfe2wpfC2C:3-168,C:286-357
P39051DB03147FAD2wpfe2wpfC3C:169-285
P39051DB03147FAD2wpfe2wpfD1D:358-488
P39051DB03147FAD2wpfe2wpfD2D:-2-168,D:286-357
P39051DB03147FAD2wpfe2wpfD3D:169-285