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HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 8uvs

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 Y7K
Residue . / 1842
Chain YLB / 1a
Non-redundant True
Interacting RNA chains FA/1a
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains FA/1a: rRNA
RNA family global rRNA
Volume 408.51 Å3
Hydrophobicity 0.184
Hydrophilicity 1.107
Buriedness 0.702
Don/acc character 1.926
SiteScore 1.153
D Score 1.000
Kd

Compound Y7K
Residue . / 1841
Chain JID / 2a
Non-redundant True
Interacting RNA chains JC/2a
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains JC/2a: rRNA
RNA family global rRNA
Volume 341.63 Å3
Hydrophobicity 0.226
Hydrophilicity 1.120
Buriedness 0.704
Don/acc character 2.290
SiteScore 1.154
D Score 0.997
Kd