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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 4p6f

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 3.60
System mass 4523.03 kDa
Deposition year 2014
Molecule type RNA/Protein
# RNA entities 1
Organism Escherichia
RCSB PDB Entry 4p6f
Reference Washington Arren Z., Benicewicz Derek B., Canzoneri Joshua C., Fagan Crystal E., Mwakwari Sandra C., Maehigashi Tatsuya, Dunham Christine M., Oyelere Adegboyega K.. 2014. Macrolide-Peptide Conjugates as Probes of the Path of Travel of the Nascent Peptides through the Ribosome ACS Chemical Biology
Equivalence Class NR_all_65795.87
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 PAR
Residue . / 1667
Chain YF / QA
Non-redundant True
Interacting RNA chains A/QA
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/QA: rRNA
RNA family global rRNA
Volume 446.59 Å3
Hydrophobicity 0.147
Hydrophilicity 1.013
Buriedness 0.675
Don/acc character 2.813
SiteScore 1.118
D Score 0.986
Kd

Compound PAR
Residue . / 1672
Chain XS / XA
Non-redundant True
Interacting RNA chains FB/XA
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains FB/XA: rRNA
RNA family global rRNA
Volume 348.15 Å3
Hydrophobicity 0.131
Hydrophilicity 1.033
Buriedness 0.694
Don/acc character 3.875
SiteScore 1.051
D Score 0.894
Kd