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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 8oiv

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 2.12
System mass 75.86 kDa
Deposition year 2023
Molecule type RNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 8oiv
Reference Skvara Petr, Chalupska Dominika, Klima Martin, Kozic Jan, Silhan Jan, Boura Evzen. 2023. Structural basis for RNA-cap recognition and methylation by the mpox methyltransferase VP39 Antiviral Research
Equivalence Class NR_all_11916.1
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 SAH
Residue . / 401
Chain D / A
Non-redundant True
Interacting RNA chains C/D
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains C/D: synthetic construct
RNA family global synthetic construct
Volume 235.30 Å3
Hydrophobicity 0.749
Hydrophilicity 1.252
Buriedness 0.784
Don/acc character 0.522
SiteScore 1.057
D Score 1.002
Kd