Ligand name: 5-(5-chloro-2,4-dihydroxyphenyl)-N-ethyl-4-[4-(morpholin-4-ylmethyl)phenyl]isoxazole-3-carboxamide
PDB ligand accession: 2EQ
DrugBank: DB06961
PubChem: 135525416
ChEMBL: CHEMBL398346
InChI Key: APGOABVITLQCKW-UHFFFAOYSA-N
SMILES: CCNC(=O)C1=NOC(=C1C1=CC=C(CN2CCOCC2)C=C1)C1=C(O)C=C(O)C(Cl)=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P07900

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 58 Acetylation PyMOL_RFAA
LYS 100 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
TYR 216 Phosphorylation PyMOL_RFAA PyMOL_Chai1
SER 50 Phosphorylation PyMOL_RFAA
LYS 100 Succinylation PyMOL_RFAA PyMOL_RFAA
MET 98 Sulfoxidation PyMOL_RFAA
LYS 58 Ubiquitination
LYS 185 Ubiquitination
LYS 69 Acetylation PyMOL_RFAA
LYS 69 Ubiquitination