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Structure and dynamics of RNA repeat expansions that cause Huntington's Disease and myotonic dystrophy type 1
Authors
Chen, J.L., VanEtten, D.M., Fountain, M.A., Yildirim, I., Disney, M.D.
Assembly
RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3')
Entity
1. RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3') (polymer, Thiol state: not present), 15 monomers, 4892.941 × 2 Da Detail

GACCAGCAGC AGGUC


Total weight
9785.882 Da
Max. entity weight
4892.941 Da
Source organism
Homo sapiens
Exptl. method
solution NMR
Data set
assigned_chemical_shifts, spectral_peak_list
Chem. Shift Complete1
Sequence coverage: 100.0 %, Completeness: 52.7 %, Completeness (bb): 48.9 % Detail

Polymer type: polyribonucleotide

Total1H
All52.7 % (69 of 131)52.7 % (69 of 131)
Suger, PO448.9 % (44 of 90)48.9 % (44 of 90)
Nucleobase61.0 % (25 of 41)61.0 % (25 of 41)
Aromatic80.6 % (25 of 31)80.6 % (25 of 31)

1. entity 1

GACCAGCAGC AGGUC

Sample #1

Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 6, Details 0.5 mM NA Adenosine, Cytidine,Guanosine, Uridine RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3'), 5.0 mM potassium phosphate, 0.25 mM EDTA, 100% D2O.


#NameIsotope labelingTypeConcentration
1EDTAnatural abundance0.25 mM
2RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3')NA Adenosine, Cytidine,Guanosine, Uridine0.5 mM
3potassium phosphatenatural abundance5.0 mM
Sample #2

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6, Details 0.5 mM NA Adenosine, Cytidine,Guanosine, Uridine RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3'), 5.0 mM potassium phosphate, 0.25 mM EDTA, 95% H2O/5% D2O.


#NameIsotope labelingTypeConcentration
4EDTAnatural abundance0.25 mM
5RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3')NA Adenosine, Cytidine,Guanosine, Uridine0.5 mM
6potassium phosphatenatural abundance5.0 mM

Chem. Shift Complete2
Sequence coverage: 100.0 %, Completeness: 41.2 %, Completeness (bb): 29.4 % Detail

Polymer type: polyribonucleotide

Total1H
All41.2 % (108 of 262)41.2 % (108 of 262)
Suger, PO429.4 % (53 of 180)29.4 % (53 of 180)
Nucleobase67.1 % (55 of 82)67.1 % (55 of 82)
Aromatic72.6 % (45 of 62)72.6 % (45 of 62)

1. entity 1

GACCAGCAGC AGGUC

Sample #1

Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 6, Details 0.5 mM NA Adenosine, Cytidine,Guanosine, Uridine RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3'), 5.0 mM potassium phosphate, 0.25 mM EDTA, 100% D2O.


#NameIsotope labelingTypeConcentration
1EDTAnatural abundance0.25 mM
2RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3')NA Adenosine, Cytidine,Guanosine, Uridine0.5 mM
3potassium phosphatenatural abundance5.0 mM
Sample #2

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6, Details 0.5 mM NA Adenosine, Cytidine,Guanosine, Uridine RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3'), 5.0 mM potassium phosphate, 0.25 mM EDTA, 95% H2O/5% D2O.


#NameIsotope labelingTypeConcentration
4EDTAnatural abundance0.25 mM
5RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3')NA Adenosine, Cytidine,Guanosine, Uridine0.5 mM
6potassium phosphatenatural abundance5.0 mM

Release date
2017-04-26
Citation
Structure and dynamics of RNA repeat expansions that cause Huntington's Disease and myotonic dystrophy type 1
Chen, J.L., VanEtten, D.M., Fountain, M.A., Yildirim, I., Disney, M.D.
Biochemistry (2017), 56, 3463-3474, PubMed 28617590 , DOI 10.1021/acs.biochem.7b00252 ,
Entries sharing articles BMRB: 1 entries Detail
  BMRB: 30283 released on 2017-04-26
    Title Structure and dynamics of RNA repeat expansions that cause Huntington's Disease and myotonic dystrophy type 1
Related entities 1. RNA (5'-R(*GP*AP*CP*CP*AP*GP*CP*AP*G)-3'), : 1 : 1 : 4 entities Detail
Experiments performed 2 experiments Detail
nullKeywords AA pair, CAG repeat, Huntington's Disease, RNA, repeat expansion, triplet repeat