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Attributes

UniProt ID
Protein Name
3-dehydroquinate dehydratase
Ligand Name
(2R)-2-METHYL-3-DEHYDROQUINIC ACID
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
YHBCRPWBCJOXAZ-MIZGGHSWSA-N
SMILES
CC1C(=O)C(C(CC1(C(=O)O)O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4CNO
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Color Legend
Unassigned regionsLigand / hetero atomse4cnoA1e4cnoB1e4cnoC1e4cnoD1
ECOD domains from experimental PDB structures interacting with ligand 9PY
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P24670n/a9PY4cnoe4cnoA1A:2-252
P24670n/a9PY4cnoe4cnoB1B:2-252
P24670n/a9PY4cnoe4cnoC1C:1-252
P24670n/a9PY4cnoe4cnoD1D:2-252