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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 4e8p

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 3.28
System mass 131.47 kDa
Deposition year 2012
Molecule type RNA
# RNA entities 1
Organism Oceanobacillus
RCSB PDB Entry 4e8p
Reference Marcia Marco, Pyle Anna Marie. 2012. Visualizing Group II Intron Catalysis through the Stages of Splicing Cell
Equivalence Class NR_all_35054.12
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 EPE
Residue . / 447
Chain VA / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: ribozyme
RNA family global ribozyme
Volume 71.00 Å3
Hydrophobicity 0.010
Hydrophilicity 1.061
Buriedness 0.560
Don/acc character 4.385
SiteScore 0.618
D Score 0.366
Kd

Compound EPE
Residue . / 448
Chain WA / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: ribozyme
RNA family global ribozyme
Volume 123.14 Å3
Hydrophobicity 0.049
Hydrophilicity 0.760
Buriedness 0.486
Don/acc character 2.853
SiteScore 1.062
D Score 0.984
Kd

Compound EPE
Residue . / 449
Chain XA / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: ribozyme
RNA family global ribozyme
Volume 69.29 Å3
Hydrophobicity 0.561
Hydrophilicity 0.775
Buriedness 0.672
Don/acc character 1.187
SiteScore 0.715
D Score 0.490
Kd

Compound EPE
Residue . / 451
Chain ZA / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: ribozyme
RNA family global ribozyme
Volume 154.69 Å3
Hydrophobicity 0.025
Hydrophilicity 0.967
Buriedness 0.613
Don/acc character 2.589
SiteScore 0.741
D Score 0.523
Kd

Compound SPM
Residue . / 446
Chain UA / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: ribozyme
RNA family global ribozyme
Volume 192.08 Å3
Hydrophobicity 0.273
Hydrophilicity 0.794
Buriedness 0.641
Don/acc character 1.083
SiteScore 0.778
D Score 0.577
Kd