Attributes
UniProt ID
Protein Name
Aldo-keto reductase family 1 member B1
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: 1ABN
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Color Legend
Unassigned regionsLigand / hetero atomse1abnA1
ECOD domains from experimental PDB structures interacting with ligand DB02338
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P15121 | DB02338 | NDP | 1abn | e1abnA1 | A:2-313 |
| P15121 | DB02338 | NDP | 1us0 | e1us0A1 | A:0-313 |
| P15121 | DB02338 | NDP | 1z3n | e1z3nA1 | A:0-313 |
| P15121 | DB02338 | NDP | 2f2k | e2f2kA1 | A:1-313 |
| P15121 | DB02338 | NDP | 2i16 | e2i16A1 | A:2-314 |
| P15121 | DB02338 | NDP | 2i17 | e2i17A1 | A:2-314 |
| P15121 | DB02338 | NDP | 2pev | e2pevA1 | A:0-313 |
| P15121 | DB02338 | NDP | 2pf8 | e2pf8A1 | A:0-313 |
| P15121 | DB02338 | NDP | 2pfh | e2pfhA1 | A:0-313 |
| P15121 | DB02338 | NDP | 2qxw | e2qxwA1 | A:2-312 |
| P15121 | DB02338 | NDP | 3g5e | e3g5eA1 | A:0-315 |
| P15121 | DB02338 | NDP | 3ghr | e3ghrA1 | A:0-315 |
| P15121 | DB02338 | NDP | 3ghs | e3ghsA1 | A:0-315 |
| P15121 | DB02338 | NDP | 3ght | e3ghtA1 | A:0-315 |
| P15121 | DB02338 | NDP | 3ghu | e3ghuA1 | A:0-315 |