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HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 5tbw

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 7AL
Residue . / 4210
Chain GKA / 1
Non-redundant True
Interacting RNA chains A/1
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/1: rRNA
RNA family global rRNA
Volume 357.06 Å3
Hydrophobicity 0.221
Hydrophilicity 1.150
Buriedness 0.664
Don/acc character 0.770
SiteScore 0.977
D Score 0.963
Kd

Compound 7AL
Residue . / 4246
Chain EVB / AR
Non-redundant True
Interacting RNA chains TA/AR
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains TA/AR: rRNA
RNA family global rRNA
Volume 353.63 Å3
Hydrophobicity 0.071
Hydrophilicity 1.431
Buriedness 0.645
Don/acc character 0.575
SiteScore 0.965
D Score 0.861
Kd