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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 3epk

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 3.20
System mass 141.76 kDa
Deposition year 2008
Molecule type RNA/Protein
# RNA entities 1
Organism Saccharomyces
RCSB PDB Entry 3epk
Reference Zhou Chun, Huang Raven H.. 2008. Crystallographic snapshots of eukaryotic dimethylallyltransferase acting on tRNA: Insight into tRNA recognition and reaction mechanism Proceedings of the National Academy of Sciences
Equivalence Class NR_all_45040.3
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 DST
Residue . / 422
Chain I / A
Non-redundant True
Interacting RNA chains B/E
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains B/E: tRNA
RNA family global tRNA
Volume 329.62 Å3
Hydrophobicity 0.000
Hydrophilicity 1.875
Buriedness 0.861
Don/acc character 0.429
SiteScore 1.109
D Score 0.845
Kd