PDB ligand accession: N9H
DrugBank: DB08250
PubChem:
ChEMBL: n/a
InChI Key: OQMVLDZJPRSNOG-NRFANRHFSA-N
SMILES: CCNC(=O)N1N=C(C[C@@]1(CCCN)C1=CC=CC=C1)C1=C(F)C=CC(F)=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 120 | Phosphorylation | PyMOL_RFAA | ||
TYR | 125 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
THR | 126 | Phosphorylation | PyMOL_RFAA | ||
TYR | 211 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
TYR | 231 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
SER | 232 | Phosphorylation | PyMOL_RFAA | ||
THR | 222 | Phosphorylation | PyMOL_RFAA | ||
LYS | 207 | Ubiquitination | |||
LYS | 216 | Ubiquitination |