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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6nd6

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 2.85
System mass 4572.35 kDa
Deposition year 2018
Molecule type RNA/Protein
# RNA entities 1
Organism Thermus
RCSB PDB Entry 6nd6
Reference Svetlov Maxim S., Plessa Elena, Chen Chih-Wei, Bougas Anthony, Krokidis Marios G., Dinos George P., Polikanov Yury S.. 2019. High-resolution crystal structures of ribosome-bound chloramphenicol and erythromycin provide the ultimate basis for their competition RNA
Equivalence Class NR_all_97519.80
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 ERY
Residue . / 4074
Chain PSA / 1A
Non-redundant True
Interacting RNA chains A/1A
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/1A: rRNA
RNA family global rRNA
Volume 637.98 Å3
Hydrophobicity 0.355
Hydrophilicity 1.538
Buriedness 0.763
Don/acc character 0.519
SiteScore 1.193
D Score 0.896
Kd

Compound ERY
Residue . / 3875
Chain VRC / 2A
Non-redundant True
Interacting RNA chains EB/2A
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains EB/2A: rRNA
RNA family global rRNA
Volume 137.54 Å3
Hydrophobicity 0.531
Hydrophilicity 1.228
Buriedness 0.618
Don/acc character 0.836
SiteScore 0.985
D Score 0.768
Kd