Ligand name: N-(2-AMINOETHYL)-N~2~-{(1S)-1-[4'-(AMINOSULFONYL)BIPHENYL-4-YL]-2,2,2-TRIFLUOROETHYL}-L-LEUCINAMIDE
PDB ligand accession: NFT
DrugBank: DB08270
PubChem: 46937137
ChEMBL: n/a
InChI Key: QPXXBNKMAHUXBB-PMACEKPBSA-N
SMILES: [H][C@@](CC(C)C)(N[C@@]([H])(C1=CC=C(C=C1)C1=CC=C(C=C1)S(N)(=O)=O)C(F)(F)F)C(=O)NCCN
Drug action: n/a

List of small molecule binding-associated PTMs for P43235

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
TYR 203 Phosphorylation PyMOL_Chai1
CYS 139 S-nitrosylation PyMOL_Chai1