PDB ligand accession: BAI
DrugBank: DB01767
PubChem:
ChEMBL:
InChI Key: KKJYVDXDZURHMA-UHFFFAOYSA-N
SMILES: NC(=N)C1=CC2=C(NC(CC3=NC4=C(N3)C=CC=C4)=N2)C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 599 | Acetylation | PyMOL_Chai1 | ||
ASN | 416 | N-linked_glycosylation | |||
THR | 540 | Phosphorylation | PyMOL_Chai1 |