Ligand name: 4-(1,3-Benzodioxol-5-Yl)-5-(5-Ethyl-2,4-Dihydroxyphenyl)-2h-Pyrazole-3-Carboxylic Acid
PDB ligand accession: 4BC
DrugBank: DB02840
PubChem: 656974
ChEMBL: CHEMBL178130
InChI Key: LCTWZJKHOGKNMX-UHFFFAOYSA-N
SMILES: CCC1=C(O)C=C(O)C(=C1)C1=NNC(C(O)=O)=C1C1=CC=C2OCOC2=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P07900

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	58	Acetylation			PyMOL_Chai1
LYS	100	Acetylation			PyMOL_Chai1
LYS	112	Acetylation			PyMOL_Chai1
SER	52	Phosphorylation			PyMOL_Chai1
SER	53	Phosphorylation			PyMOL_Chai1
THR	90	Phosphorylation			PyMOL_Chai1
THR	94	Phosphorylation			PyMOL_Chai1
THR	99	Phosphorylation		PyMOL_RFAA
THR	109	Phosphorylation			PyMOL_Chai1
SER	113	Phosphorylation			PyMOL_Chai1
THR	115	Phosphorylation			PyMOL_Chai1
SER	50	Phosphorylation			PyMOL_Chai1
LYS	100	Succinylation		PyMOL_RFAA	PyMOL_Chai1 PyMOL_Chai1
MET	98	Sulfoxidation			PyMOL_Chai1
LYS	58	Ubiquitination
LYS	112	Ubiquitination
LYS	185	Ubiquitination