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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 5xz1

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 3.01
System mass 30.18 kDa
Deposition year 2017
Molecule type RNA
# RNA entities 1
Organism N/A
RCSB PDB Entry 5xz1
Equivalence Class NR_all_71199.7
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 GET
Residue . / 101
Chain E / A
Non-redundant False
Interacting RNA chains A/A, B/B
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: rRNA, B/B: rRNA
RNA family global rRNA
Volume 117.65 Å3
Hydrophobicity 0.225
Hydrophilicity 0.869
Buriedness 0.572
Don/acc character 1.481
SiteScore 0.841
D Score 0.669
Kd

Compound GET
Residue . / 301
Chain F / B
Non-redundant False
Interacting RNA chains A/A, B/B
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: rRNA, B/B: rRNA
RNA family global rRNA
Volume 81.98 Å3
Hydrophobicity 0.104
Hydrophilicity 0.950
Buriedness 0.578
Don/acc character 2.140
SiteScore 0.788
D Score 0.593
Kd

Compound GET
Residue . / 101
Chain G / C
Non-redundant False
Interacting RNA chains C/C, D/D
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains C/C: rRNA, D/D: rRNA
RNA family global rRNA
Volume 436.30 Å3
Hydrophobicity 0.065
Hydrophilicity 1.011
Buriedness 0.610
Don/acc character 1.535
SiteScore 1.097
D Score 0.976
Kd

Compound GET
Residue . / 102
Chain H / C
Non-redundant False
Interacting RNA chains C/C, D/D
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains C/C: rRNA, D/D: rRNA
RNA family global rRNA
Volume 95.70 Å3
Hydrophobicity 0.237
Hydrophilicity 0.854
Buriedness 0.591
Don/acc character 1.337
SiteScore 0.833
D Score 0.656
Kd