Complex 8f4o
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 | 3.10 |
| System mass | 62.34 kDa |
| Deposition year | 2022 |
| Molecule type | RNA |
| # RNA entities | 1 |
| Organism | Escherichia |
| RCSB PDB Entry | 8f4o |
| Reference | Lee Hyun Kyung, Lee Yun-Tzai, Fan Lixin, Wilt Haley M., Conrad Chelsie E., Yu Ping, Zhang Jinwei, Shi Genbin, Ji Xinhua, Wang Yun-Xing, Stagno Jason R.. 2023. Crystal structure of Escherichia coli thiamine pyrophosphate-sensing riboswitch in the apo state Structure |
| Equivalence Class |
NR_all_62404.3
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 | PG4 |
| Residue | . / 113 |
| Chain | GA / B |
| Non-redundant | True |
| Interacting RNA chains | B/B |
| RNA environment detailled | ion |
| RNA environment global | RNA |
| RNA family chains | B/B: riboswitch |
| RNA family global | riboswitch |
| Volume | 157.09 Å3 |
| Hydrophobicity | 0.051 |
| Hydrophilicity | 1.330 |
| Buriedness | 0.652 |
| Don/acc character | 0.560 |
| SiteScore | 0.808 |
| D Score | 0.498 |
| Kd | — |