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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7wii

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 2.75
System mass 16.54 kDa
Deposition year 2022
Molecule type RNA
# RNA entities 1
Organism Mesorhizobium
RCSB PDB Entry 7wii
Reference Xu Lilei, Xiao Yu, Zhang Jie, Fang Xianyang. 2023. Structural insights into translation regulation by the THF-II riboswitch Nucleic Acids Research
Equivalence Class NR_all_52535.3
BGSU version: 4.52

Pockets List

Legend

Cell colors for SiteScore and D Score:

 Favourable

 Intermediate

 Unfavourable

 Not available

ScoreThresholdMeaning
SiteScore< 0.8Non-drug binding site
SiteScore0.8 – 1.0Potential drug binding site
SiteScore> 1.0Promising binding site
D Score< 0.83Undruggable
D Score0.83 – 0.98Difficult
D Score> 0.98Druggable

Tick a pocket below to highlight it in the 3D structure above.

Compound NPR
Residue . / 101
Chain B / V
Non-redundant True
Interacting RNA chains A/V
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/V: riboswitch
RNA family global riboswitch
Volume 214.72 Å3
Hydrophobicity 0.432
Hydrophilicity 0.896
Buriedness 0.687
Don/acc character 1.754
SiteScore 1.019
D Score 0.866
Kd