Attributes
UniProt ID
Protein Name
Isocitrate dehydrogenase kinase/phosphatase
Ligand Name
ADENOSINE MONOPHOSPHATE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
UDMBCSSLTHHNCD-KQYNXXCUSA-N
SMILES
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)O)O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3EPS
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Color Legend
Unassigned regionsLigand / hetero atomse3epsA1e3epsA2e3epsB1e3epsB2
ECOD domains from experimental PDB structures interacting with ligand DB00131
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q8X607 | DB00131 | AMP | 3eps | e3epsA1 | A:2-308 |
| Q8X607 | DB00131 | AMP | 3eps | e3epsA2 | A:309-574 |
| Q8X607 | DB00131 | AMP | 3eps | e3epsB1 | B:2-308 |
| Q8X607 | DB00131 | AMP | 3eps | e3epsB2 | B:309-574 |
| Q8X607 | DB00131 | AMP | 4p69 | e4p69A1 | A:309-571 |
| Q8X607 | DB00131 | AMP | 4p69 | e4p69A2 | A:4-308 |
| Q8X607 | DB00131 | AMP | 4p69 | e4p69B1 | B:309-571 |
| Q8X607 | DB00131 | AMP | 4p69 | e4p69B2 | B:5-308 |