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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6rw5

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 3.14
System mass 1258.06 kDa
Deposition year 2019
Molecule type RNA/Protein
# RNA entities 1
Organism Homo
RCSB PDB Entry 6rw5
Reference Khawaja Anas, Itoh Yuzuru, Remes Cristina, Spåhr Henrik, Yukhnovets Olessya, Höfig Henning, Amunts Alexey, Rorbach Joanna. 2020. Distinct pre-initiation steps in human mitochondrial translation Nature Communications
Equivalence Class NR_all_93855.32
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 NAD
Residue . / 1701
Chain HA / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/A: rRNA
RNA family global rRNA
Volume 938.45 Å3
Hydrophobicity 0.269
Hydrophilicity 1.314
Buriedness 0.837
Don/acc character 0.745
SiteScore 0.813
D Score 1.014
Kd

Compound SPM
Residue . / 1702
Chain IA / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: rRNA
RNA family global rRNA
Volume 733.68 Å3
Hydrophobicity 0.190
Hydrophilicity 1.169
Buriedness 0.828
Don/acc character 2.701
SiteScore 1.237
D Score 1.056
Kd

Compound SRY
Residue . / 1703
Chain JA / A
Non-redundant True
Interacting RNA chains A/A
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/A: rRNA
RNA family global rRNA
Volume 283.66 Å3
Hydrophobicity 0.238
Hydrophilicity 1.047
Buriedness 0.686
Don/acc character 3.337
SiteScore 1.085
D Score 0.937
Kd