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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6upy

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 3.40
System mass 488.02 kDa
Deposition year 2019
Molecule type RNA/DNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 6upy
Reference Oh Juntaek, Fleming Aaron M., Xu Jun, Chong Jenny, Burrows Cynthia J., Wang Dong. 2020. RNA polymerase II stalls on oxidative DNA damage via a torsion-latch mechanism involving lone pair–π and CH–π interactions Proceedings of the National Academy of Sciences

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 APC
Residue . / 1301
Chain Q / B
Non-redundant True
Interacting RNA chains A/R
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/R: synthetic construct
RNA family global synthetic construct
Volume 344.72 Å3
Hydrophobicity 0.329
Hydrophilicity 1.117
Buriedness 0.761
Don/acc character 1.616
SiteScore 0.961
D Score 0.928
Kd