PDB ligand accession: 575
DrugBank: DB07156
PubChem:
ChEMBL:
InChI Key: JFEKAVPMVOLVTH-UNOMPAQXSA-N
SMILES: BrC1=CC=C2C(=O)NC(=O)\C(=C/NC3=CC=C(CN4CCCC4)C=C3)C2=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 1088 | Acetylation | PyMOL_RFAA | ||
SER | 1009 | Phosphorylation | PyMOL_RFAA | ||
TYR | 1014 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
LYS | 1033 | Ubiquitination |