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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7edm

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 2.81
System mass 16.14 kDa
Deposition year 2021
Molecule type RNA
# RNA entities 1
Organism N/A
RCSB PDB Entry 7edm
Equivalence Class NR_all_71199.7
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 GET
Residue . / 101
Chain E / B
Non-redundant False
Interacting RNA chains B/B, A/A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: rRNA, B/B: rRNA
RNA family global rRNA
Volume 73.40 Å3
Hydrophobicity 0.131
Hydrophilicity 0.997
Buriedness 0.543
Don/acc character 1.987
SiteScore 0.808
D Score 0.625
Kd

Compound GET
Residue . / 102
Chain F / B
Non-redundant False
Interacting RNA chains B/B, A/A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: rRNA, B/B: rRNA
RNA family global rRNA
Volume 83.01 Å3
Hydrophobicity 0.173
Hydrophilicity 0.975
Buriedness 0.555
Don/acc character 1.023
SiteScore 0.786
D Score 0.595
Kd