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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 4q9r

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 3.12
System mass 74.68 kDa
Deposition year 2014
Molecule type RNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 4q9r
Reference Huang Hao, Suslov Nikolai B, Li Nan-Sheng, Shelke Sandip A, Evans Molly E, Koldobskaya Yelena, Rice Phoebe A, Piccirilli Joseph A. 2014. A G-quadruplex–containing RNA activates fluorescence in a GFP-like fluorophore Nature Chemical Biology
Equivalence Class NR_all_27557.4
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 2ZY
Residue . / 102
Chain E / R
Non-redundant True
Interacting RNA chains C/R
RNA environment detailled ion
RNA environment global RNA
RNA family chains C/R: aptamer_rna
RNA family global aptamer_rna
Volume 451.73 Å3
Hydrophobicity 0.508
Hydrophilicity 0.848
Buriedness 0.628
Don/acc character 2.137
SiteScore 1.140
D Score 1.040
Kd