PDB ligand accession: FAD
DrugBank: DB03147
PubChem:
ChEMBL:
InChI Key: VWWQXMAJTJZDQX-UYBVJOGSSA-N
SMILES: CC1=CC2=C(C=C1C)N(C[C@H](O)[C@H](O)[C@H](O)CO[P@](O)(=O)O[P@@](O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC3=C1N=CN=C3N)C1=NC(=O)NC(=O)C1=N2
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| LYS | 120 | Acetylation | PyMOL_AF3 | PyMOL_RFAA | |
| LYS | 115 | Acetylation | PyMOL_AF3 | PyMOL_RFAA | |
| TYR | 80 | Phosphorylation | PyMOL_AF3 | PyMOL_Chai1 | |
| THR | 95 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
| SER | 146 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
| THR | 182 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
| THR | 185 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
| TYR | 130 | Phosphorylation | PyMOL_AF3 | PyMOL_Chai1 | |
| TYR | 113 | Phosphorylation | PyMOL_AF3 | PyMOL_Chai1 | |
| THR | 117 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
| THR | 57 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
| TYR | 94 | Phosphorylation | PyMOL_AF3 | PyMOL_Chai1 | |
| SER | 98 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
| LYS | 115 | Ubiquitination | |||
| LYS | 120 | Ubiquitination | |||
| LYS | 126 | Ubiquitination | |||
| LYS | 111 | Ubiquitination | |||
| LYS | 214 | Ubiquitination |