Ligand name: 2-[4-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]iminocyclohexa-2,5-dien-1-yl]acetonitrile
PDB ligand accession: GVD
DrugBank: DB07853
PubChem: n/a
ChEMBL: n/a
InChI Key: AWMNWCNUTIFHRJ-JLPGSUDCSA-N
SMILES: N#CCC1C=CC(C=C1)=NC1=NC2=CC=CC=C2C(NC2=NNC(=C2)C2CC2)=N1
Drug action: n/a

List of small molecule binding-associated PTMs for Q9P289

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 40 Acetylation PyMOL_RFAA
SER 34 Phosphorylation PyMOL_RFAA
TYR 101 Phosphorylation PyMOL_Chai1
SER 106 Phosphorylation PyMOL_RFAA
LYS 32 Ubiquitination
LYS 40 Ubiquitination
LYS 146 Ubiquitination
LYS 159 Ubiquitination
LYS 53 Ubiquitination