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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 4v5d

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 3.50
System mass 4516.21 kDa
Deposition year 2009
Molecule type RNA/Protein
# RNA entities 1
Organism Thermus
RCSB PDB Entry 4v5d
Reference Voorhees Rebecca M, Weixlbaumer Albert, Loakes David, Kelley Ann C, Ramakrishnan V. 2009. Insights into substrate stabilization from snapshots of the peptidyl transferase center of the intact 70S ribosome Nature Structural & Molecular 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 . / 1799
Chain AL / AA
Non-redundant False
Interacting RNA chains A/AA
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/AA: rRNA
RNA family global rRNA
Volume 243.19 Å3
Hydrophobicity 0.103
Hydrophilicity 1.053
Buriedness 0.640
Don/acc character 1.540
SiteScore 0.992
D Score 0.827
Kd

Compound PAR
Residue . / 1800
Chain CLA / CA
Non-redundant True
Interacting RNA chains FB/CA
RNA environment detailled ion
RNA environment global RNA
RNA family chains FB/CA: rRNA
RNA family global rRNA
Volume 523.76 Å3
Hydrophobicity 0.072
Hydrophilicity 1.459
Buriedness 0.661
Don/acc character 1.275
SiteScore 1.125
D Score 0.861
Kd