Ligand name: 10-Propargyl-5,8-Dideazafolic Acid
PDB ligand accession: CB3
DrugBank: DB03541
PubChem: 443388;5281971;135438608;
ChEMBL: CHEMBL389051
InChI Key: LTKHPMDRMUCUEB-IBGZPJMESA-N
SMILES: [H][C@@](CCC(O)=O)(NC(=O)C1=CC=C(C=C1)N(CC#C)CC1=CC=C2NC(N)=NC(=O)C2=C1)C(O)=O
Drug action: n/a

List of small molecule binding-associated PTMs for P04818

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	77	Acetylation		PyMOL_RFAA
LYS	107	Acetylation		PyMOL_RFAA
TYR	135	Phosphorylation			PyMOL_Chai1
THR	306	Phosphorylation		PyMOL_RFAA
LYS	308	Sumoylation
LYS	77	Ubiquitination
LYS	104	Ubiquitination
LYS	107	Ubiquitination
LYS	308	Ubiquitination