PDB ligand accession: EHD
DrugBank: DB04690
PubChem:
ChEMBL:
InChI Key: VSJKWCGYPAHWDS-FQEVSTJZSA-N
SMILES: CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=CC=CC=C4N=C13)C2=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 354 | Acetylation | PyMOL_RFAA | ||
LYS | 436 | Acetylation | PyMOL_RFAA | ||
LYS | 720 | Acetylation | PyMOL_RFAA | ||
TYR | 426 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
SER | 534 | Phosphorylation | PyMOL_RFAA | ||
LYS | 354 | Ubiquitination |