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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 3ovs

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 2.80
System mass 127.26 kDa
Deposition year 2010
Molecule type RNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 3ovs
Reference Pan Baocheng, Xiong Yong, Steitz Thomas A.. 2010. How the CCA-Adding Enzyme Selects Adenine over Cytosine at Position 76 of tRNA Science
Equivalence Class NR_all_65533.3
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 CTP
Residue . / 501
Chain E / A
Non-redundant True
Interacting RNA chains C/C
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains C/C: tRNA
RNA family global tRNA
Volume 528.22 Å3
Hydrophobicity 0.098
Hydrophilicity 1.569
Buriedness 0.838
Don/acc character 0.604
SiteScore 1.093
D Score 0.931
Kd

Compound CTP
Residue . / 502
Chain N / B
Non-redundant False
Interacting RNA chains D/D
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains D/D: tRNA
RNA family global tRNA
Volume 578.98 Å3
Hydrophobicity 0.109
Hydrophilicity 1.561
Buriedness 0.837
Don/acc character 0.666
SiteScore 1.093
D Score 0.933
Kd