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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6xa1

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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 2.80
System mass 3134.50 kDa
Deposition year 2020
Molecule type RNA/Protein
# RNA entities 1
Organism Homo
RCSB PDB Entry 6xa1
Reference Li Wenfei, Chang Stacey Tsai-Lan, Ward Fred. R., Cate Jamie H. D.. 2020. Selective inhibition of human translation termination by a drug-like compound Nature Communications
Equivalence Class NR_all_65061.63
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 MVM
Residue . / 5246
Chain UH / L5
Non-redundant True
Interacting RNA chains C/L5
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains C/L5: rRNA
RNA family global rRNA
Volume 447.27 Å3
Hydrophobicity 0.529
Hydrophilicity 1.458
Buriedness 0.856
Don/acc character 0.681
SiteScore 1.036
D Score 0.890
Kd