PDB ligand accession: DTF
DrugBank: DB03276
PubChem:
ChEMBL:
InChI Key: RHYFMOCFCFUTNH-GZNVFMSSSA-N
SMILES: NC(=O)C[C@@H]1NC(=O)C2(CCCCC2)NC(=O)C[C@H](\C=C\C[C@H](CNC1=O)CC1=CC=CC2=CC=CC=C12)C1=CC=C(C=C1)CP(O)(O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 64 | Acetylation | PyMOL_RFAA | ||
LYS | 109 | Acetylation | PyMOL_RFAA | ||
LYS | 117 | Acetylation | PyMOL_RFAA | ||
LYS | 109 | Malonylation | PyMOL_RFAA | ||
SER | 88 | Phosphorylation | PyMOL_RFAA | ||
SER | 90 | Phosphorylation | PyMOL_RFAA | ||
TYR | 118 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 134 | Phosphorylation | PyMOL_Chai1 | ||
SER | 96 | Phosphorylation | PyMOL_RFAA | ||
LYS | 69 | Ubiquitination | |||
LYS | 109 | Ubiquitination |