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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 4wf1

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 NEG
Residue . / 1657
Chain RP / CA
Non-redundant True
Interacting RNA chains BB/CA
RNA environment detailled ion
RNA environment global RNA
RNA family chains BB/CA: rRNA
RNA family global rRNA
Volume 206.83 Å3
Hydrophobicity 0.237
Hydrophilicity 1.106
Buriedness 0.727
Don/acc character 1.481
SiteScore 1.088
D Score 0.911
Kd