Attributes
UniProt ID
Protein Name
Alliin lyase 1
Ligand Name
2-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]ACRYLIC ACID
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BXUDKFHCAMQSRX-UHFFFAOYSA-N
SMILES
Cc1c(c(c(cn1)COP(=O)(O)O)CNC(=C)C(=O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 2HOX
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Color Legend
Unassigned regionsLigand / hetero atomse2hoxA1e2hoxA3e2hoxA4e2hoxB1e2hoxB2e2hoxB3e2hoxC1e2hoxC2e2hoxC3e2hoxD1e2hoxD2e2hoxD3
ECOD domains from experimental PDB structures interacting with ligand P1T
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q01594 | n/a | P1T | 2hox | e2hoxA1 | A:313-425 |
| Q01594 | n/a | P1T | 2hox | e2hoxA3 | A:59-312 |
| Q01594 | n/a | P1T | 2hox | e2hoxB1 | B:59-312 |
| Q01594 | n/a | P1T | 2hox | e2hoxB2 | B:313-427 |
| Q01594 | n/a | P1T | 2hox | e2hoxC1 | C:59-312 |
| Q01594 | n/a | P1T | 2hox | e2hoxC2 | C:313-425 |
| Q01594 | n/a | P1T | 2hox | e2hoxD2 | D:313-427 |
| Q01594 | n/a | P1T | 2hox | e2hoxD3 | D:59-312 |