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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 5vw1

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 2.60
System mass 197.15 kDa
Deposition year 2017
Molecule type RNA/Protein
# RNA entities 1
Organism Listeria
RCSB PDB Entry 5vw1
Reference Yang Hui, Patel Dinshaw J.. 2017. Inhibition Mechanism of an Anti-CRISPR Suppressor AcrIIA4 Targeting SpyCas9 Molecular Cell
Equivalence Class NR_all_43299.1
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 PG4
Residue . / 102
Chain I / C
Non-redundant True
Interacting RNA chains B/C
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains B/C: unknown
RNA family global unknown
Volume 296.01 Å3
Hydrophobicity 0.191
Hydrophilicity 1.601
Buriedness 0.896
Don/acc character 0.700
SiteScore 1.133
D Score 0.956
Kd