| Index | Ligand Name | Structure | PDB code | ligand desolvation |
| 1 | lls | human cGAS core domain (K427E/K428E) bound with RU-521 | 6o47 | 88.85 |
| 2 | juj | human cGAS catalytic domain bound with the inhibitor G150 | 6mjw | 74.03 |
| 3 | jum | human cGAS catalytic domain bound with the inhibitor G108 | 6mju | 73.52 |
| 4 | kkp | CYCLIC GMP-AMP SYNTHASE in complex with compound 16 inhibitor: 7-hydroxy-N-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide | 6nfg | 73.14 |
| 5 | kkm | CYCLIC GMP-AMP SYNTHASE in complex with compound 20 inhibitor: 7-hydroxy-N-[(2S)-1-hydroxypropan-2-yl]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide | 6nfo | 71.54 |