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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 9mqs

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 Electron Microscopy
Experimental resolution 3.10
System mass 107.41 kDa
Deposition year 2025
Molecule type RNA
# RNA entities 1
Organism Candida
RCSB PDB Entry 9mqs
Reference Liu Tianshuo, Xu Ling, Chung Kevin, Sisto Luke J., Hwang Jimin, Zhang Chengxin, Van Zandt Michael C., Pyle Anna Marie. 2025. Molecular insights into de novo small-molecule recognition by an intron RNA structure Proceedings of the National Academy of Sciences
Equivalence Class NR_all_71108.2
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 5GP
Residue . / 409
Chain J / A
Non-redundant True
Interacting RNA chains A/A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: ribozyme
RNA family global ribozyme
Volume 397.19 Å3
Hydrophobicity 0.028
Hydrophilicity 1.180
Buriedness 0.725
Don/acc character 2.729
SiteScore 1.146
D Score 0.962
Kd