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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7fj0

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 Solution NMR
Experimental resolution N/A
System mass 6.80 kDa
Deposition year 2021
Molecule type RNA
# RNA entities 1
Organism Mus
RCSB PDB Entry 7fj0
Reference Nagano Konami, Kamimura Takashi, Kawai Gota. 2022. Interaction between a fluoroquinolone derivative and RNAs with a single bulge The Journal of Biochemistry
Equivalence Class NR_all_89167.1
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 53D
Residue . / 101
Chain B / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: unknown
RNA family global unknown
Volume 53.85 Å3
Hydrophobicity 1.110
Hydrophilicity 0.348
Buriedness 0.502
Don/acc character 4.088
SiteScore 0.953
D Score 0.872
Kd