Attributes
UniProt ID
Protein Name
Myeloperoxidase
Ligand Name
3-[(2R)-2-ethoxypropyl]-2-thioxo-1,2,3,9-tetrahydro-6H-purin-6-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
QOTIDWBGIWZLOV-ZCFIWIBFSA-N
SMILES
CCOC(C)CN1c2c(nc[nH]2)C(=O)NC1=S
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 4DL1
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Color Legend
Unassigned regionsLigand / hetero atomse4dl1.1e4dl1.2e4dl1.3e4dl1.4e4dl1.5e4dl1.6e4dl1.8e4dl1.9
ECOD domains from experimental PDB structures interacting with ligand 0KY
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P05164 | n/a | 0KY | 4dl1 | e4dl1.1 | A:1-104,C:113-577 |
| P05164 | n/a | 0KY | 4dl1 | e4dl1.2 | E:1-104,G:113-575 |
| P05164 | n/a | 0KY | 4dl1 | e4dl1.3 | F:1-104,H:113-575 |
| P05164 | n/a | 0KY | 4dl1 | e4dl1.4 | J:1-104,L:113-575 |
| P05164 | n/a | 0KY | 4dl1 | e4dl1.5 | I:1-104,K:113-575 |
| P05164 | n/a | 0KY | 4dl1 | e4dl1.6 | M:1-104,O:113-575 |
| P05164 | n/a | 0KY | 4dl1 | e4dl1.8 | B:1-104,D:113-575 |
| P05164 | n/a | 0KY | 4dl1 | e4dl1.9 | N:1-104,P:113-575 |