HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Complex 8u5k

System information

Experimental technique X-ray
Experimental resolution 2.80
System mass 37.36 kDa
Deposition year 2023
Molecule type RNA
# RNA entities 1
Organism N/A
RCSB PDB Entry 8u5k
Reference Lu Xiaocen, Passalacqua Luiz F M, Nodwell Matthew, Kong Kristen Y S, Caballero-García Guillermo, Dolgosheina Elena V, Ferré-D’Amaré Adrian R, Britton Robert, Unrau Peter J. . Symmetry breaking of fluorophore binding to a G-quadruplex generates an RNA aptamer with picomolar KD Nucleic Acids Research
Equivalence Class NR_all_82829.3
BGSU version: 4.48

Compound VK0
Residue . / 104
Chain G / A
Non-redundant True
Interacting RNA chains A/A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: aptamer_rna
RNA family global aptamer_rna
Volume 307.67 Å3
Hydrophobicity 0.513
Hydrophilicity 0.717
Buriedness 0.589
Don/acc character 4.093
SiteScore 1.139
D Score 1.060
Kd

Compound VK0
Residue . / 103
Chain J / B
Non-redundant False
Interacting RNA chains B/B
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains B/B: aptamer_rna
RNA family global aptamer_rna
Volume 321.05 Å3
Hydrophobicity 0.521
Hydrophilicity 0.687
Buriedness 0.603
Don/acc character 4.483
SiteScore 1.155
D Score 1.078
Kd

Compound VK0
Residue . / 104
Chain N / C
Non-redundant False
Interacting RNA chains C/C
RNA environment detailled ion
RNA environment global RNA
RNA family chains C/C: aptamer_rna
RNA family global aptamer_rna
Volume 317.96 Å3
Hydrophobicity 0.499
Hydrophilicity 0.746
Buriedness 0.615
Don/acc character 3.238
SiteScore 1.151
D Score 1.066
Kd