HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Complex 6xb7

System information

Experimental technique Solution NMR
Experimental resolution N/A
System mass 13.46 kDa
Deposition year 2020
Molecule type RNA
# RNA entities 1
Organism Enterovirus
RCSB PDB Entry 6xb7
Reference Davila-Calderon Jesse, Patwardhan Neeraj N., Chiu Liang-Yuan, Sugarman Andrew, Cai Zhengguo, Penutmutchu Srinivasa R., Li Mei-Ling, Brewer Gary, Hargrove Amanda E., Tolbert Blanton S.. . IRES-targeting small molecule inhibits enterovirus 71 replication via allosteric stabilization of a ternary complex Nature Communications
Molecular Dynamics Simulation mmb-A01WF, mmb-A01WG, mmb-A01WI, mmb-A022D, mmb-A022N
Equivalence Class NR_all_39508.1
BGSU version: 4.48

Compound UYS
Residue . / 101
Chain B / A
Non-redundant True
Interacting RNA chains A/A
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains A/A: rRNA
RNA family global rRNA
Volume 219.18 Å3
Hydrophobicity 0.611
Hydrophilicity 0.861
Buriedness 0.628
Don/acc character 2.999
SiteScore 1.138
D Score 1.036
Kd