Ligand name: [1-(6-{6-[(1-methylethyl)amino]-1H-indazol-1-yl}pyrazin-2-yl)-1H-pyrrol-3-yl]acetic acid
PDB ligand accession: CCK
DrugBank: DB07546
PubChem: 16224058
ChEMBL: CHEMBL1231683
InChI Key: BBYRUZKRFAIQSR-UHFFFAOYSA-N
SMILES: CC(C)NC1=CC2=C(C=NN2C2=NC(=CN=C2)N2C=CC(CC(O)=O)=C2)C=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P19784

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	50	Acetylation		PyMOL_RFAA
LYS	97	Acetylation		PyMOL_RFAA
LYS	159	Acetylation		PyMOL_RFAA
TYR	51	Phosphorylation			PyMOL_Chai1
SER	52	Phosphorylation		PyMOL_RFAA
MET	164	Sulfoxidation		PyMOL_RFAA
LYS	159	Ubiquitination
LYS	45	Ubiquitination
LYS	50	Ubiquitination