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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7m4x

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 2.66
System mass 2167.15 kDa
Deposition year 2021
Molecule type RNA/Protein
# RNA entities 1
Organism Acinetobacter
RCSB PDB Entry 7m4x
Reference Zhang Zhemin, Morgan Christopher E., Bonomo Robert A., Yu Edward W.. 2021. Cryo-EM Determination of Eravacycline-Bound Structures of the Ribosome and the Multidrug Efflux Pump AdeJ of Acinetobacter baumannii mBio
Equivalence Class NR_all_43481.6, NR_all_96169.5
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 YQM
Residue . / 3201
Chain CB / A
Non-redundant True
Interacting RNA chains E/A
RNA environment detailled ion, other
RNA environment global RNA/Other
RNA family chains E/A: rRNA
RNA family global rRNA
Volume 569.04 Å3
Hydrophobicity 0.076
Hydrophilicity 1.608
Buriedness 0.664
Don/acc character 1.277
SiteScore 1.127
D Score 0.814
Kd

Compound YQM
Residue . / 3202
Chain DB / A
Non-redundant True
Interacting RNA chains E/A
RNA environment detailled ion, other
RNA environment global RNA/Other
RNA family chains E/A: rRNA
RNA family global rRNA
Volume 240.10 Å3
Hydrophobicity 0.055
Hydrophilicity 1.631
Buriedness 0.709
Don/acc character 1.238
SiteScore 0.937
D Score 0.552
Kd

Compound YQM
Residue . / 1601
Chain MG / a
Non-redundant True
Interacting RNA chains EA/a
RNA environment detailled ion
RNA environment global RNA
RNA family chains EA/a: rRNA
RNA family global rRNA
Volume 174.59 Å3
Hydrophobicity 0.566
Hydrophilicity 0.817
Buriedness 0.698
Don/acc character 1.906
SiteScore 0.934
D Score 0.769
Kd