Attributes
UniProt ID
Protein Name
Catechol 1,2-dioxygenase
Ligand Name
(4S,7R)-4-HYDROXY-N,N,N-TRIMETHYL-9-OXO-7-[(PALMITOYLOXY)METHYL]-3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-1-AMINIUM 4-OXIDE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PZNPLUBHRSSFHT-RRHRGVEJSA-O
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3HGI
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Color Legend
Unassigned regionsLigand / hetero atomse3hgiA1
ECOD domains from experimental PDB structures interacting with ligand 6PL
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P95607 | n/a | 6PL | 3hgi | e3hgiA1 | A:23-280 |
| P95607 | n/a | 6PL | 3hhx | e3hhxA1 | A:25-280 |
| P95607 | n/a | 6PL | 3hhy | e3hhyA1 | A:25-280 |
| P95607 | n/a | 6PL | 3hj8 | e3hj8A1 | A:24-280 |
| P95607 | n/a | 6PL | 3hjq | e3hjqA1 | A:25-280 |
| P95607 | n/a | 6PL | 3hjs | e3hjsA1 | A:25-280 |
| P95607 | n/a | 6PL | 3hkp | e3hkpA1 | A:25-280 |
| P95607 | n/a | 6PL | 3i4v | e3i4vA1 | A:25-280 |
| P95607 | n/a | 6PL | 3i4y | e3i4yA1 | A:25-280 |
| P95607 | n/a | 6PL | 3i51 | e3i51A1 | A:25-280 |