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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 2g5k

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 2.80
System mass 16.16 kDa
Deposition year 2006
Molecule type RNA
# RNA entities 1
Organism N/A
RCSB PDB Entry 2g5k
Reference Kondo Jiro, François Boris, Urzhumtsev Alexandre, Westhof Eric. 2006. Crystal Structure of the Homo sapiens Cytoplasmic Ribosomal Decoding Site Complexed with Apramycin Angewandte Chemie International Edition
Equivalence Class NR_all_54657.3
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 AM2
Residue . / 102
Chain C / A
Non-redundant True
Interacting RNA chains A/A, B/B
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: rRNA, B/B: rRNA
RNA family global rRNA
Volume 258.97 Å3
Hydrophobicity 0.084
Hydrophilicity 0.923
Buriedness 0.638
Don/acc character 2.137
SiteScore 0.943
D Score 0.779
Kd 0.5uM

Compound AM2
Residue . / 101
Chain F / B
Non-redundant True
Interacting RNA chains A/A, B/B
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: rRNA, B/B: rRNA
RNA family global rRNA
Volume 270.28 Å3
Hydrophobicity 0.060
Hydrophilicity 0.871
Buriedness 0.626
Don/acc character 2.802
SiteScore 0.946
D Score 0.789
Kd 0.5uM