Attributes
UniProt ID
Protein Name
Isocitrate dehydrogenase , mitochondrial -specific ICDH
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: 2QFX
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Color Legend
Unassigned regionsLigand / hetero atomse2qfxA1e2qfxA2e2qfxB1e2qfxB2e2qfxC1e2qfxC2e2qfxD1e2qfxD2e2qfxE1e2qfxE2e2qfxF1e2qfxF2
ECOD domains from experimental PDB structures interacting with ligand DB02338
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P21954 | DB02338 | NDP | 2qfx | e2qfxA1 | A:107-288 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxA2 | A:2-106,A:289-411 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxB1 | B:107-288 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxB2 | B:2-106,B:289-411 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxC1 | C:2-106,C:289-411 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxC2 | C:107-288 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxD1 | D:107-288 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxD2 | D:2-106,D:289-411 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxE1 | E:107-288 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxE2 | E:2-106,E:289-411 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxF1 | F:2-106,F:289-411 |
| P21954 | DB02338 | NDP | 2qfx | e2qfxF2 | F:107-288 |