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HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7uvv

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 OI9
Residue . / 3001
Chain CB / A
Non-redundant True
Interacting RNA chains E/A
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains E/A: rRNA
RNA family global rRNA
Volume 321.39 Å3
Hydrophobicity 0.343
Hydrophilicity 0.898
Buriedness 0.679
Don/acc character 2.017
SiteScore 1.023
D Score 0.873
Kd

Compound OI9
Residue . / 1601
Chain DB / a
Non-redundant True
Interacting RNA chains EA/a
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains EA/a: rRNA
RNA family global rRNA
Volume 323.45 Å3
Hydrophobicity 0.156
Hydrophilicity 1.067
Buriedness 0.692
Don/acc character 1.479
SiteScore 1.101
D Score 0.949
Kd