Ligand name: (5E,7S)-2-amino-7-(4-fluoro-2-pyridin-3-ylphenyl)-4-methyl-7,8-dihydroquinazolin-5(6H)-one oxime
PDB ligand accession: MOJ
DrugBank: DB08197
PubChem: 46937132
ChEMBL: CHEMBL1234416
InChI Key: KYIXUSLGFINPTC-WVFAEZDRSA-N
SMILES: [H][C@]1(C\C(=N/O)C2=C(C1)N=C(N)N=C2C)C1=CC=C(F)C=C1C1=CC=CN=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 100 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
TYR 160 Phosphorylation PyMOL_RFAA PyMOL_Chai1
SER 164 Phosphorylation PyMOL_RFAA
SER 50 Phosphorylation PyMOL_RFAA
THR 171 Phosphorylation PyMOL_RFAA
LYS 100 Succinylation PyMOL_RFAA PyMOL_RFAA
MET 98 Sulfoxidation PyMOL_RFAA
LYS 58 Ubiquitination
LYS 112 Ubiquitination
LYS 185 Ubiquitination