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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 8cgv

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 Electron Microscopy
Experimental resolution 1.66
System mass 1332.80 kDa
Deposition year 2023
Molecule type RNA/Protein
# RNA entities 1
Organism Escherichia
RCSB PDB Entry 8cgv
Reference Paternoga Helge, Crowe-McAuliffe Caillan, Bock Lars V., Koller Timm O., Morici Martino, Beckert Bertrand, Myasnikov Alexander G., Grubmüller Helmut, Nováček Jiří, Wilson Daniel N.. 2023. Structural conservation of antibiotic interaction with ribosomes Nature Structural & Molecular Biology
Equivalence Class NR_all_83717.187
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 MUL
Residue . / 3003
Chain GA / a
Non-redundant True
Interacting RNA chains E/a
RNA environment detailled ion
RNA environment global RNA
RNA family chains E/a: rRNA
RNA family global rRNA
Volume 463.39 Å3
Hydrophobicity 0.897
Hydrophilicity 0.812
Buriedness 0.774
Don/acc character 1.661
SiteScore 1.180
D Score 1.056
Kd

Compound P8F
Residue . / 3001
Chain EA / a
Non-redundant True
Interacting RNA chains E/a
RNA environment detailled ion, other
RNA environment global RNA/Other
RNA family chains E/a: rRNA
RNA family global rRNA
Volume 626.66 Å3
Hydrophobicity 0.209
Hydrophilicity 1.239
Buriedness 0.713
Don/acc character 1.567
SiteScore 1.160
D Score 0.964
Kd

Compound P8F
Residue . / 3002
Chain FA / a
Non-redundant True
Interacting RNA chains E/a
RNA environment detailled ion, other
RNA environment global RNA/Other
RNA family chains E/a: rRNA
RNA family global rRNA
Volume 170.13 Å3
Hydrophobicity 0.168
Hydrophilicity 1.574
Buriedness 0.695
Don/acc character 0.798
SiteScore 0.953
D Score 0.594
Kd