Ligand name: Inhibitor Idd 384
PDB ligand accession: I84
DrugBank: DB01689
PubChem: 1944
ChEMBL: CHEMBL240719
InChI Key: CJKKMQCZOLCXAM-UHFFFAOYSA-N
SMILES: CC1=CC=CC=C1CC(=O)NC1=CC(C)=C(C(C)=C1)S(=O)(=O)NCC(O)=O
Drug action: n/a

List of small molecule binding-associated PTMs for P15121

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	222	Acetylation		PyMOL_RFAA
LYS	263	Acetylation		PyMOL_RFAA
LYS	22	Acetylation		PyMOL_RFAA
CYS	299	Glutathionylation		PyMOL_RFAA
LYS	263	Malonylation		PyMOL_RFAA
LYS	222	Methylation		PyMOL_RFAA PyMOL_RFAA
THR	20	Phosphorylation		PyMOL_RFAA
SER	23	Phosphorylation		PyMOL_RFAA
TYR	49	Phosphorylation			PyMOL_Chai1
SER	77	Phosphorylation		PyMOL_RFAA
SER	211	Phosphorylation		PyMOL_RFAA
SER	215	Phosphorylation		PyMOL_RFAA
TYR	210	Phosphorylation			PyMOL_Chai1
SER	303	Phosphorylation		PyMOL_RFAA
CYS	299	S-nitrosylation		PyMOL_RFAA
CYS	304	S-nitrosylation		PyMOL_RFAA
LYS	263	Ubiquitination
LYS	222	Ubiquitination