PDB ligand accession: BAX
DrugBank: DB00398
PubChem:
ChEMBL:
InChI Key: MLDQJTXFUGDVEO-UHFFFAOYSA-N
SMILES: CNC(=O)C1=NC=CC(OC2=CC=C(NC(=O)NC3=CC(=C(Cl)C=C3)C(F)(F)F)C=C2)=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 562 | Phosphorylation | |||
TYR | 678 | Phosphorylation | |||
TYR | 683 | Phosphorylation | |||
TYR | 686 | Phosphorylation | |||
TYR | 692 | Phosphorylation | |||
TYR | 771 | Phosphorylation | |||
TYR | 775 | Phosphorylation |