Ligand name: NADH
PDB ligand accession: NAI
DrugBank: DB00157
PubChem: 439153
ChEMBL: CHEMBL1234616
InChI Key: BOPGDPNILDQYTO-NNYOXOHSSA-N
SMILES: NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O
Drug action: n/a

List of small molecule binding-associated PTMs for P00390

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 110 Acetylation PyMOL_RFAA
LYS 296 Acetylation PyMOL_RFAA
LYS 354 Acetylation PyMOL_RFAA
CYS 107 Glutathionylation PyMOL_RFAA
CYS 377 Glutathionylation PyMOL_RFAA
THR 383 Phosphorylation PyMOL_RFAA
THR 101 Phosphorylation PyMOL_RFAA
CYS 107 S-nitrosylation PyMOL_RFAA
CYS 377 S-nitrosylation PyMOL_RFAA