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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6b4v

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 3.40
System mass 4544.27 kDa
Deposition year 2017
Molecule type RNA/Protein
# RNA entities 1
Organism Thermus
RCSB PDB Entry 6b4v
Reference Svidritskiy Egor, Korostelev Andrei A.. 2018. Mechanism of Inhibition of Translation Termination by Blasticidin S Journal of Molecular Biology
Equivalence Class NR_all_35542.167, 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 BLS
Residue . / 9001
Chain OL / B
Non-redundant True
Interacting RNA chains B/B, IA/IA
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains B/B: rRNA, IA/IA: tRNA
RNA family global multiple
Volume 764.20 Å3
Hydrophobicity 0.110
Hydrophilicity 1.081
Buriedness 0.714
Don/acc character 1.548
SiteScore 1.160
D Score 1.016
Kd

Compound BLS
Residue . / 9001
Chain YTA / FB
Non-redundant True
Interacting RNA chains MC/MC, FB/FB
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains FB/FB: rRNA, MC/MC: tRNA
RNA family global multiple
Volume 761.46 Å3
Hydrophobicity 0.198
Hydrophilicity 1.072
Buriedness 0.734
Don/acc character 1.407
SiteScore 1.047
D Score 1.031
Kd