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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 5wws

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 3.25
System mass 154.95 kDa
Deposition year 2017
Molecule type RNA/Protein
# RNA entities 1
Organism Homo
RCSB PDB Entry 5wws
Reference Liu Ru-Juan, Long Tao, Li Jing, Li Hao, Wang En-Duo. 2017. Structural basis for substrate binding and catalytic mechanism of a human RNA:m5C methyltransferase NSun6 Nucleic Acids Research
Equivalence Class NR_all_99471.3
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 SAM
Residue . / 501
Chain E / A
Non-redundant True
Interacting RNA chains A/C
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains A/C: tRNA
RNA family global tRNA
Volume 315.22 Å3
Hydrophobicity 1.442
Hydrophilicity 1.048
Buriedness 0.926
Don/acc character 0.872
SiteScore 1.152
D Score 1.154
Kd

Compound SAM
Residue . / 501
Chain F / B
Non-redundant True
Interacting RNA chains B/D
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains B/D: tRNA
RNA family global tRNA
Volume 304.58 Å3
Hydrophobicity 1.345
Hydrophilicity 1.088
Buriedness 0.927
Don/acc character 0.917
SiteScore 1.153
D Score 1.142
Kd