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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7a0s

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).

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 QU2
Residue . / 2901
Chain CA / X
Non-redundant True
Interacting RNA chains A/X
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/X: rRNA
RNA family global rRNA
Volume 542.28 Å3
Hydrophobicity 0.235
Hydrophilicity 1.579
Buriedness 0.737
Don/acc character 1.189
SiteScore 1.176
D Score 0.868
Kd