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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6uet

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 Electron Microscopy
Experimental resolution 4.10
System mass 38.92 kDa
Deposition year 2019
Molecule type RNA
# RNA entities 1
Organism Mycobacterium
RCSB PDB Entry 6uet
Reference Zhang Kaiming, Li Shanshan, Kappel Kalli, Pintilie Grigore, Su Zhaoming, Mou Tung-Chung, Schmid Michael F., Das Rhiju, Chiu Wah. 2019. Cryo-EM structure of a 40 kDa SAM-IV riboswitch RNA at 3.7 Å resolution Nature Communications
Equivalence Class NR_all_74364.3
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 SAM
Residue . / 301
Chain B / A
Non-redundant True
Interacting RNA chains A/A
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: riboswitch
RNA family global riboswitch
Volume 762.49 Å3
Hydrophobicity 0.464
Hydrophilicity 0.955
Buriedness 0.735
Don/acc character 1.511
SiteScore 1.191
D Score 1.069
Kd