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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 3cma

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 2.80
System mass 1495.13 kDa
Deposition year 2008
Molecule type RNA/Protein
# RNA entities 1
Organism Haloarcula
RCSB PDB Entry 3cma
Reference Simonović Miljan, Steitz Thomas A.. 2008. Peptidyl-CCA deacylation on the ribosome promoted by induced fit and the O3′-hydroxyl group of A76 of the unacylated A-site tRNA RNA
Equivalence Class NR_all_95119.5, NR_all_26150.5
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 PHE
Residue . / 77
Chain ZL / 6
Non-redundant False
Interacting RNA chains GA/6, DA/0
RNA environment detailled other
RNA environment global RNA/Other
RNA family chains DA/0: rRNA, GA/6: rRNA
RNA family global rRNA
Volume 700.75 Å3
Hydrophobicity 0.206
Hydrophilicity 1.441
Buriedness 0.764
Don/acc character 1.110
SiteScore 1.194
D Score 0.929
Kd