Attributes
UniProt ID
Protein Name
Trypanothione reductase ,N-bisspermidine reductase
Ligand Name
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ACFIXJIJDZMPPO-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)OP(=O)(O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 2WOV
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Color Legend
Unassigned regionsLigand / hetero atomse2wovA1e2wovA2e2wovA3e2wovB1e2wovB2e2wovB3e2wovC1e2wovC2e2wovC3e2wovD1e2wovD2e2wovD3
ECOD domains from experimental PDB structures interacting with ligand DB02338
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q389T8 | DB02338 | NDP | 2wov | e2wovA1 | A:358-488 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovA2 | A:-1-168,A:286-357 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovA3 | A:169-285 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovB1 | B:358-487 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovB2 | B:2-168,B:286-357 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovB3 | B:169-285 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovC1 | C:358-488 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovC2 | C:-1-168,C:286-357 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovC3 | C:169-285 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovD1 | D:358-488 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovD2 | D:2-168,D:286-357 |
| Q389T8 | DB02338 | NDP | 2wov | e2wovD3 | D:169-285 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowA1 | A:358-488 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowA2 | A:-1-168,A:286-357 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowA3 | A:169-285 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowB1 | B:358-489 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowB2 | B:2-168,B:286-357 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowB3 | B:169-285 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowC1 | C:358-489 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowC2 | C:-1-168,C:286-357 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowC3 | C:169-285 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowD1 | D:358-491 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowD2 | D:2-168,D:286-357 |
| Q389T8 | DB02338 | NDP | 2wow | e2wowD3 | D:169-285 |