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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 6gb2

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 3.20
System mass 1993.75 kDa
Deposition year 2018
Molecule type RNA/Protein
# RNA entities 1
Organism Sus
RCSB PDB Entry 6gb2
Reference Kummer Eva, Leibundgut Marc, Rackham Oliver, Lee Richard G., Boehringer Daniel, Filipovska Aleksandra, Ban Nenad. 2018. Unique features of mammalian mitochondrial translation initiation revealed by cryo-EM Nature
Equivalence Class NR_all_24610.5
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 5GP
Residue . / 3203
Chain HJ / BA
Non-redundant True
Interacting RNA chains Q/BA
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains Q/BA: rRNA
RNA family global rRNA
Volume 325.51 Å3
Hydrophobicity 0.221
Hydrophilicity 0.973
Buriedness 0.640
Don/acc character 1.888
SiteScore 1.026
D Score 0.881
Kd

Compound 5GP
Residue . / 3204
Chain IJ / BA
Non-redundant True
Interacting RNA chains Q/BA
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains Q/BA: rRNA
RNA family global rRNA
Volume 231.87 Å3
Hydrophobicity 0.242
Hydrophilicity 1.460
Buriedness 0.577
Don/acc character 0.640
SiteScore 1.069
D Score 0.811
Kd

Compound SPM
Residue . / 3205
Chain JJ / BA
Non-redundant True
Interacting RNA chains Q/BA
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains Q/BA: rRNA
RNA family global rRNA
Volume 665.08 Å3
Hydrophobicity 0.160
Hydrophilicity 1.349
Buriedness 0.792
Don/acc character 1.738
SiteScore 1.063
D Score 0.976
Kd

Compound SPM
Residue . / 201
Chain WJ / BR
Non-redundant True
Interacting RNA chains Q/BA
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains Q/BA: rRNA
RNA family global rRNA
Volume 600.25 Å3
Hydrophobicity 0.237
Hydrophilicity 1.098
Buriedness 0.740
Don/acc character 1.371
SiteScore 1.028
D Score 1.026
Kd