PDB ligand accession: SNX
DrugBank: DB08557
PubChem:
ChEMBL:
InChI Key: XQKFKSJUBJPOLY-UHFFFAOYSA-N
SMILES: COCCNC1=CC(=CC=C1C(N)=O)N1C2=C(C3=CC=CC=C13)C(=O)CCC2
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 58 | Acetylation | PyMOL_RFAA | ||
LYS | 100 | Acetylation | PyMOL_RFAA | ||
LYS | 112 | Acetylation | PyMOL_RFAA | ||
SER | 52 | Phosphorylation | PyMOL_RFAA | ||
SER | 53 | Phosphorylation | PyMOL_RFAA | ||
THR | 90 | Phosphorylation | PyMOL_RFAA | ||
THR | 94 | Phosphorylation | PyMOL_RFAA | ||
THR | 99 | Phosphorylation | PyMOL_RFAA | ||
THR | 109 | Phosphorylation | PyMOL_RFAA | ||
SER | 113 | Phosphorylation | PyMOL_RFAA | ||
THR | 115 | Phosphorylation | PyMOL_RFAA | ||
TYR | 160 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
SER | 164 | Phosphorylation | PyMOL_RFAA | ||
SER | 169 | Phosphorylation | PyMOL_RFAA | ||
SER | 50 | Phosphorylation | PyMOL_RFAA | ||
THR | 171 | Phosphorylation | PyMOL_RFAA | ||
LYS | 100 | Succinylation | PyMOL_RFAA PyMOL_RFAA | ||
MET | 98 | Sulfoxidation | PyMOL_RFAA | ||
LYS | 58 | Ubiquitination | |||
LYS | 112 | Ubiquitination | |||
LYS | 185 | Ubiquitination |