Complex 8khh
Legend
Pocket colors by molecule type
RNA
Protein
DNA
These colors appear when a pocket is selected (the structure fades to show the pocket surface). Colors from the molecule-type palette (RNA / protein / DNA).
System information
| Experimental technique | X-ray |
| Experimental resolution | 2.30 |
| System mass | 46.21 kDa |
| Deposition year | 2023 |
| Molecule type | RNA |
| # RNA entities | 1 |
| Organism | Bacillus |
| RCSB PDB Entry | 8khh |
| Reference | Chen Ke, Liao Wenjian, Wang Jiali, Ren Yangyi, Lu Zhizhong, Peng Xuemei, Wang Jia, Huang Lin. 2025. Crystal structures reveal the distinct features of the 2′-dG-III riboswitch in the purine riboswitch family Nucleic Acids Research |
| Equivalence Class |
NR_all_91735.4
BGSU version: 4.52 |
Pockets List
Legend
Cell colors for SiteScore and D Score:
Favourable
Intermediate
Unfavourable
Not available
| Score | Threshold | Meaning |
|---|---|---|
| SiteScore | < 0.8 | Non-drug binding site |
| SiteScore | 0.8 – 1.0 | Potential drug binding site |
| SiteScore | > 1.0 | Promising binding site |
| D Score | < 0.83 | Undruggable |
| D Score | 0.83 – 0.98 | Difficult |
| D Score | > 0.98 | Druggable |
Tick a pocket below to highlight it in the 3D structure above.
| Compound | GMP |
| Residue | . / 101 |
| Chain | C / A |
| Non-redundant | True |
| Interacting RNA chains | A/A |
| RNA environment detailled | ion |
| RNA environment global | RNA |
| RNA family chains | A/A: riboswitch |
| RNA family global | riboswitch |
| Volume | 379.36 Å3 |
| Hydrophobicity | 0.213 |
| Hydrophilicity | 1.154 |
| Buriedness | 0.718 |
| Don/acc character | 1.278 |
| SiteScore | 1.163 |
| D Score | 0.995 |
| Kd | — |
| Compound | GMP |
| Residue | . / 101 |
| Chain | J / B |
| Non-redundant | False |
| Interacting RNA chains | B/B |
| RNA environment detailled | RNA-only |
| RNA environment global | RNA |
| RNA family chains | B/B: riboswitch |
| RNA family global | riboswitch |
| Volume | 428.75 Å3 |
| Hydrophobicity | 0.152 |
| Hydrophilicity | 1.144 |
| Buriedness | 0.744 |
| Don/acc character | 1.269 |
| SiteScore | 1.180 |
| D Score | 1.013 |
| Kd | — |