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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 8r6y

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 3.40
System mass 255.92 kDa
Deposition year 2023
Molecule type RNA/Protein
# RNA entities 1
Organism Bandavirus
RCSB PDB Entry 8r6y
Reference Williams Harry M, Thorkelsson Sigurdur R, Vogel Dominik, Busch Carola, Milewski Morlin, Cusack Stephen, Grünewald Kay, Quemin Emmanuelle R J, Rosenthal Maria. 2024. Structural snapshots of phenuivirus cap-snatching and transcription Nucleic Acids Research
Equivalence Class NR_all_00699.3, NR_all_39866.1
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 2KH
Residue . / 2101
Chain F / A
Non-redundant False
Interacting RNA chains D/G, C/T
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains C/T: unknown, D/G: unknown
RNA family global unknown
Volume 416.75 Å3
Hydrophobicity 1.022
Hydrophilicity 1.138
Buriedness 0.877
Don/acc character 0.970
SiteScore 1.120
D Score 1.095
Kd