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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7aap

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 GE6
Residue . / 1601
Chain M / T
Non-redundant True
Interacting RNA chains F/T, E/P
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains E/P: unknown, F/T: unknown
RNA family global unknown
Volume 245.25 Å3
Hydrophobicity 0.553
Hydrophilicity 1.224
Buriedness 0.866
Don/acc character 0.863
SiteScore 0.801
D Score 0.661
Kd