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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 2o5j

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 3.00
System mass 790.55 kDa
Deposition year 2006
Molecule type RNA/DNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 2o5j
Reference Vassylyev Dmitry G., Vassylyeva Marina N., Zhang Jinwei, Palangat Murali, Artsimovitch Irina, Landick Robert. 2007. Structural basis for substrate loading in bacterial RNA polymerase Nature

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 APC
Residue . / 3999
Chain U / D
Non-redundant True
Interacting RNA chains B/H
RNA environment detailled DNA, protein, ion
RNA environment global RNA/DNA/Protein
RNA family chains B/H: unknown
RNA family global unknown
Volume 763.18 Å3
Hydrophobicity 0.529
Hydrophilicity 1.423
Buriedness 0.867
Don/acc character 0.685
SiteScore 1.113
D Score 0.996
Kd

Compound APC
Residue . / 4999
Chain Z / N
Non-redundant True
Interacting RNA chains E/Y
RNA environment detailled DNA, protein, ion
RNA environment global RNA/DNA/Protein
RNA family chains E/Y: unknown
RNA family global unknown
Volume 698.69 Å3
Hydrophobicity 0.665
Hydrophilicity 1.151
Buriedness 0.876
Don/acc character 1.171
SiteScore 1.119
D Score 1.090
Kd