Ligand name: ATP
PDB ligand accession: ATP
DrugBank: DB00171
PubChem: 5957
ChEMBL: CHEMBL14249
InChI Key: ZKHQWZAMYRWXGA-KQYNXXCUSA-N
SMILES: NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O
Drug action: n/a

List of small molecule binding-associated PTMs for P68400

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	49	Acetylation	PyMOL_AF3	PyMOL_RFAA
LYS	122	Acetylation	PyMOL_AF3	PyMOL_RFAA
TYR	50	Phosphorylation	PyMOL_AF3		PyMOL_Chai1
SER	51	Phosphorylation	PyMOL_AF3	PyMOL_RFAA
MET	163	Sulfoxidation		PyMOL_RFAA
LYS	49	Ubiquitination
LYS	122	Ubiquitination
LYS	68	Ubiquitination
LYS	158	Ubiquitination
LYS	44	Ubiquitination
LYS	64	Ubiquitination
SER	194	Phosphorylation	PyMOL_AF3	PyMOL_RFAA
TYR	196	Phosphorylation	PyMOL_AF3		PyMOL_Chai1