Ligand name: 2,4-Diamino-5-Methyl-6-[(3,4,5-Trimethoxy-N-Methylanilino)Methyl]Pyrido[2,3-D]Pyrimidine
PDB ligand accession: CO4
DrugBank: DB02104
PubChem: 447815
ChEMBL: CHEMBL50514
InChI Key: PEGMMEYCSOZKIT-UHFFFAOYSA-N
SMILES: COC1=CC(=CC(OC)=C1OC)N(C)CC1=C(C)C2=C(N)N=C(N)N=C2N=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P00374

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 174 Acetylation PyMOL_RFAA
LYS 64 Acetylation PyMOL_RFAA
THR 39 Phosphorylation PyMOL_RFAA
SER 12 Phosphorylation PyMOL_RFAA
TYR 178 Phosphorylation PyMOL_Chai1
LYS 174 Ubiquitination
LYS 179 Ubiquitination