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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 8t8c

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 2.60
System mass 4431.93 kDa
Deposition year 2023
Molecule type RNA/Protein
# RNA entities 1
Organism Thermus
RCSB PDB Entry 8t8c
Reference Thaler Julia, Syroegin Egor A., Breuker Kathrin, Polikanov Yury S., Micura Ronald. 2023. Practical Synthesis of N -Formylmethionylated Peptidyl-tRNA Mimics ACS Chemical Biology
Equivalence Class NR_all_42622.80, NR_all_97519.80
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 ARG
Residue . / 4030
Chain XQA / 1A
Non-redundant True
Interacting RNA chains A/1A
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/1A: rRNA
RNA family global rRNA
Volume -
Hydrophobicity -
Hydrophilicity -
Buriedness -
Don/acc character -
SiteScore -
D Score -
Kd

Compound ARG
Residue . / 230
Chain CSA / 1B
Non-redundant True
Interacting RNA chains B/1B
RNA environment detailled ion
RNA environment global RNA
RNA family chains B/1B: rRNA
RNA family global rRNA
Volume 123.82 Å3
Hydrophobicity 0.000
Hydrophilicity 2.150
Buriedness 0.626
Don/acc character 1.018
SiteScore 0.932
D Score 0.397
Kd