PDB ligand accession: 486
DrugBank: DB00834
PubChem:
ChEMBL:
InChI Key: VKHAHZOOUSRJNA-GCNJZUOMSA-N
SMILES: [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@H](C1=CC=C(C=C1)N(C)C)C1=C3CCC(=O)C=C3CC[C@@]21[H]
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 640 | Phosphorylation | PyMOL_Chai1 |