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HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 5dox

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 HGR
Residue . / 3749
Chain UFA / 1A
Non-redundant True
Interacting RNA chains A/1A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/1A: rRNA
RNA family global rRNA
Volume 473.00 Å3
Hydrophobicity 1.195
Hydrophilicity 0.691
Buriedness 0.735
Don/acc character 1.555
SiteScore 1.242
D Score 1.156
Kd

Compound HGR
Residue . / 3515
Chain HKB / 2A
Non-redundant True
Interacting RNA chains AB/2A
RNA environment detailled ion
RNA environment global RNA
RNA family chains AB/2A: rRNA
RNA family global rRNA
Volume 411.94 Å3
Hydrophobicity 0.909
Hydrophilicity 0.829
Buriedness 0.747
Don/acc character 1.355
SiteScore 1.223
D Score 1.118
Kd