PDB ligand accession: DXC
DrugBank: DB03619
PubChem:
ChEMBL:
InChI Key: KXGVEGMKQFWNSR-LLQZFEROSA-N
SMILES: [H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 69 | Phosphorylation | PyMOL_Chai1 | ||
LYS | 423 | Ubiquitination | |||
THR | 1019 | Phosphorylation | PyMOL_Chai1 |