Ligand name: NADPH
PDB ligand accession: NDP
DrugBank: DB02338
PubChem: 5884;134821689;
ChEMBL: CHEMBL407009
InChI Key: ACFIXJIJDZMPPO-NNYOXOHSSA-N
SMILES: NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O
Drug action: n/a

List of small molecule binding-associated PTMs for Q12882

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
SER 392 Phosphorylation PyMOL_AF3 PyMOL_RFAA
SER 227 Phosphorylation PyMOL_AF3 PyMOL_RFAA
MET 377 Sulfoxidation PyMOL_RFAA
LYS 307 Ubiquitination