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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 5ns4

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).

System information

Experimental technique X-ray
Experimental resolution 2.40
System mass 62.85 kDa
Deposition year 2017
Molecule type RNA/Protein
# RNA entities 1
Organism Thermus
RCSB PDB Entry 5ns4
Reference Liu Yijin, Lilley David M.J.. 2017. Crystal Structures of Cyanine Fluorophores Stacked onto the End of Double-Stranded RNA Biophysical Journal
Equivalence Class NR_all_09715.3
BGSU version: 4.52

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 96T
Residue . / 101
Chain G / C
Non-redundant True
Interacting RNA chains C/C
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains C/C: unknown
RNA family global unknown
Volume 119.02 Å3
Hydrophobicity 0.082
Hydrophilicity 1.007
Buriedness 0.616
Don/acc character 1.664
SiteScore 0.627
D Score 0.565
Kd