Ligand name: Coenzyme A
PDB ligand accession: COA
DrugBank: DB01992
PubChem: 87642
ChEMBL: CHEMBL1213327
InChI Key: RGJOEKWQDUBAIZ-IBOSZNHHSA-N
SMILES: CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCS
Drug action: n/a

List of small molecule binding-associated PTMs for P04035

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 474 Ubiquitination
LYS 480 Ubiquitination
LYS 692 Ubiquitination
LYS 502 Malonylation
LYS 502 Ubiquitination
ASN 870 N-linked_glycosylation