Ligand name: (10R)-10-methyl-3-(6-methylpyridin-3-yl)-9,10,11,12-tetrahydro-8H-[1,4]diazepino[5',6':4,5]thieno[3,2-f]quinolin-8-one
PDB ligand accession: B97
DrugBank: DB07430
PubChem: 44631903
ChEMBL: CHEMBL1231206
InChI Key: CMWRPDHVGMHLSZ-GFCCVEGCSA-N
SMILES: [H][C@@]1(C)CNC2=C(SC3=C2C2=C(C=C3)N=C(C=C2)C2=CN=C(C)C=C2)C(=O)N1
Drug action: n/a

List of small molecule binding-associated PTMs for P49137

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
THR 206 Phosphorylation PyMOL_RFAA
LYS 353 Sumoylation
LYS 93 Ubiquitination
LYS 204 Ubiquitination
LYS 353 Ubiquitination