Ligand name: 5'-O-(N-(Alanyl)sulfamoyl)adenosine
PDB ligand accession: A5A
DrugBank: DB03376
PubChem: 196672;44593540;
ChEMBL: CHEMBL1163065
InChI Key: CWWYMWDIYBJVLP-YTMOPEAISA-N
SMILES: [H]N([H])[C@@H](C)C(=O)N([H])S(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C(N=CN=C12)N([H])[H]
Drug action: n/a

List of small molecule binding-associated PTMs for P07814

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
ARG	1152	Methylation			PyMOL_Chai1 PyMOL_Chai1
TYR	1028	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1
THR	1121	Phosphorylation			PyMOL_Chai1
SER	1122	Phosphorylation			PyMOL_Chai1
TYR	1127	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1
TYR	1047	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1
THR	1124	Phosphorylation			PyMOL_Chai1
SER	1272	Phosphorylation			PyMOL_Chai1
MET	1126	Sulfoxidation			PyMOL_Chai1