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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6bjy

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 3.46
System mass 254.92 kDa
Deposition year 2017
Molecule type RNA/Protein
# RNA entities 1
Organism Vesiculovirus
RCSB PDB Entry 6bjy
Reference Gumpper Ryan H., Li Weike, Castañeda Carlos H., Scuderi M. José, Bashkin James K., Luo Ming. 2018. A Polyamide Inhibits Replication of Vesicular Stomatitis Virus by Targeting RNA in the Nucleocapsid Journal of Virology
Equivalence Class NR_all_75870.2
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 DV4
Residue . / 101
Chain G / R
Non-redundant True
Interacting RNA chains A/R
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains A/R: unknown
RNA family global unknown
Volume 575.90 Å3
Hydrophobicity 0.375
Hydrophilicity 1.242
Buriedness 0.800
Don/acc character 0.926
SiteScore 0.986
D Score 0.910
Kd