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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7om7

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 2.40
System mass 329.53 kDa
Deposition year 2021
Molecule type RNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 7om7
Reference Ferrero Diego S., Falqui Michela, Verdaguer Nuria. 2021. Snapshots of a Non-Canonical RdRP in Action Viruses
Equivalence Class NR_all_71999.2
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 2KH
Residue . / 701
Chain M / A
Non-redundant True
Interacting RNA chains E/E, F/F
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains E/E: synthetic construct, F/F: synthetic construct
RNA family global synthetic construct
Volume 700.75 Å3
Hydrophobicity 0.357
Hydrophilicity 1.313
Buriedness 0.847
Don/acc character 0.673
SiteScore 1.099
D Score 1.020
Kd

Compound 2KH
Residue . / 701
Chain O / B
Non-redundant False
Interacting RNA chains H/H, G/G
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains G/G: synthetic construct, H/H: synthetic construct
RNA family global synthetic construct
Volume 634.55 Å3
Hydrophobicity 0.212
Hydrophilicity 1.594
Buriedness 0.856
Don/acc character 0.691
SiteScore 1.106
D Score 0.934
Kd