HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Complex 4nyg

System information

Experimental technique X-ray
Experimental resolution 3.05
System mass 27.27 kDa
Deposition year 2013
Molecule type RNA
# RNA entities 1
Organism Escherichia
RCSB PDB Entry 4nyg
Reference Warner Katherine Deigan, Homan Philip, Weeks Kevin M., Smith Alison G., Abell Chris, Ferré-D’Amaré Adrian R.. . Validating Fragment-Based Drug Discovery for Biological RNAs: Lead Fragments Bind and Remodel the TPP Riboswitch Specifically Chemistry & Biology
Equivalence Class NR_all_42241.5
BGSU version: 4.48

Compound VIB
Residue . / 101
Chain B / A
Non-redundant False
Interacting RNA chains A/A
RNA environment detailled ion
RNA environment global RNA
RNA family chains A/A: riboswitch
RNA family global riboswitch
Volume 410.57 Å3
Hydrophobicity 0.564
Hydrophilicity 1.068
Buriedness 0.722
Don/acc character 1.555
SiteScore 1.166
D Score 1.025
Kd 1.5uM