Ligand name: Palbociclib
PDB ligand accession: LQQ
DrugBank: DB09073
PubChem: 5330286
ChEMBL: CHEMBL189963
InChI Key: AHJRHEGDXFFMBM-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C)C2=CN=C(NC3=NC=C(C=C3)N3CCNCC3)N=C2N(C2CCCC2)C1=O
Drug action: n/a

List of small molecule binding-associated PTMs for Q00534

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 26 Acetylation PyMOL_RFAA
LYS 43 Acetylation PyMOL_RFAA
TYR 24 Phosphorylation PyMOL_Chai1
THR 154 Phosphorylation PyMOL_RFAA
SER 155 Phosphorylation PyMOL_RFAA
LYS 26 Ubiquitination
LYS 29 Ubiquitination
LYS 147 Ubiquitination
LYS 43 Ubiquitination
LYS 111 Ubiquitination
LYS 160 Ubiquitination