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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7l6r

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 1.98
System mass 52.47 kDa
Deposition year 2020
Molecule type RNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 7l6r
Reference Minasov George, Rosas-Lemus Monica, Shuvalova Ludmilla, Inniss Nicole L., Brunzelle Joseph S., Daczkowski Courtney M., Hoover Paul, Mesecar Andrew D., Satchell Karla J. F.. 2021. Mn 2+ coordinates Cap-0-RNA to align substrates for efficient 2′- O -methyl transfer by SARS-CoV-2 nsp16 Science Signaling
Equivalence Class NR_all_11762.6
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 . / 7105
Chain H / A
Non-redundant False
Interacting RNA chains C/C
RNA environment detailled protein, other
RNA environment global RNA/Other
RNA family chains C/C: synthetic construct
RNA family global synthetic construct
Volume 215.06 Å3
Hydrophobicity 0.813
Hydrophilicity 1.262
Buriedness 0.787
Don/acc character 1.137
SiteScore 1.060
D Score 1.001
Kd