Ligand name: N-[(2-AMINO-6-METHYLPYRIMIDIN-4-YL)METHYL]-3-{[(E)-(2-OXODIHYDROFURAN-3(2H)-YLIDENE)METHYL]AMINO}BENZENESULFONAMIDE
PDB ligand accession: A94
DrugBank: DB07325
PubChem: 17755582
ChEMBL: n/a
InChI Key: VCOKUBHAJVTVNG-FMIVXFBMSA-N
SMILES: CC1=NC(N)=NC(CNS(=O)(=O)C2=CC(N\C=C3/CCOC3=O)=CC=C2)=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_RFAA
LYS	112	Acetylation		PyMOL_RFAA
SER	52	Phosphorylation		PyMOL_RFAA
SER	53	Phosphorylation		PyMOL_RFAA
THR	94	Phosphorylation		PyMOL_RFAA
THR	99	Phosphorylation		PyMOL_RFAA
THR	109	Phosphorylation		PyMOL_RFAA
SER	113	Phosphorylation		PyMOL_RFAA
THR	115	Phosphorylation		PyMOL_RFAA
SER	50	Phosphorylation		PyMOL_RFAA
MET	98	Sulfoxidation		PyMOL_RFAA
MET	130	Sulfoxidation		PyMOL_RFAA
LYS	58	Ubiquitination
LYS	112	Ubiquitination
LYS	185	Ubiquitination
TYR	61	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1