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- PDB-1xv0: Solution NMR structure of RNA internal loop with three consecutiv... -

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Basic information

Entry
Database: PDB / ID: 1xv0
TitleSolution NMR structure of RNA internal loop with three consecutive sheared GA pairs in 5'GGUGGAGGCU/3'PCCGAAGCCG
Components
  • 5'-R(*GP*CP*CP*GP*AP*AP*GP*CP*CP*(P5P)-3'
  • 5'-R(*GP*GP*UP*GP*GP*AP*GP*GP*CP*U)-3'
KeywordsRNA / Thermodynamics and Structure / Base stacking and Hydrogen bonding / 3-GA motif
Function / homologyRNA
Function and homology information
MethodSOLUTION NMR
AuthorsChen, G. / Znosko, B.M. / Kennedy, S.D. / Krugh, T.R. / Turner, D.H.
CitationJournal: Biochemistry / Year: 2005
Title: Solution Structure of an RNA Internal Loop with Three Consecutive Sheared GA Pairs
Authors: Chen, G. / Znosko, B.M. / Kennedy, S.D. / Krugh, T.R. / Turner, D.H.
History
DepositionOct 26, 2004Deposition site: RCSB / Processing site: RCSB
Revision 1.0Nov 9, 2004Provider: repository / Type: Initial release
Revision 1.1Apr 30, 2008Group: Version format compliance
Revision 1.2Jul 13, 2011Group: Version format compliance
Revision 1.3Mar 2, 2022Group: Data collection / Database references / Derived calculations
Category: database_2 / pdbx_nmr_software ...database_2 / pdbx_nmr_software / pdbx_struct_assembly / pdbx_struct_oper_list / struct_conn
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_nmr_software.name / _struct_conn.pdbx_leaving_atom_flag
Revision 1.4May 22, 2024Group: Data collection / Category: chem_comp_atom / chem_comp_bond

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
A: 5'-R(*GP*GP*UP*GP*GP*AP*GP*GP*CP*U)-3'
B: 5'-R(*GP*CP*CP*GP*AP*AP*GP*CP*CP*(P5P)-3'


Theoretical massNumber of molelcules
Total (without water)6,4572
Polymers6,4572
Non-polymers00
Water0
1


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
NMR ensembles
DataCriteria
Number of conformers (submitted / calculated)33 / 40structures with the least restraint violations
RepresentativeModel #17closest to the average

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Components

#1: RNA chain 5'-R(*GP*GP*UP*GP*GP*AP*GP*GP*CP*U)-3'


Mass: 3272.996 Da / Num. of mol.: 1 / Source method: obtained synthetically
#2: RNA chain 5'-R(*GP*CP*CP*GP*AP*AP*GP*CP*CP*(P5P)-3'


Mass: 3183.991 Da / Num. of mol.: 1 / Source method: obtained synthetically

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Experimental details

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Experiment

ExperimentMethod: SOLUTION NMR
NMR experiment
Conditions-IDExperiment-IDSolution-IDType
1112D TOCSY
1212D NOESY
231DQF-COSY
2412D NOESY

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Sample preparation

DetailsContents: 80 mM NaCl, 10 mM Sodium phosphates, 0.5 mM EDTA, pH5.9 10% D2O
Solvent system: NMR
Sample conditions
Conditions-IDpHPressure (kPa)Temperature (K)
15.9 1 atm303 K
25.9 1 atm273 K

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NMR measurement

RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M
Radiation wavelengthRelative weight: 1
NMR spectrometer
TypeManufacturerModelField strength (MHz)Spectrometer-ID
Varian INOVAVarianINOVA5001
Varian INOVAVarianINOVA6002

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Processing

NMR software
NameVersionClassification
Felix2000data analysis
Discoverstructure solution
Discoverrefinement
Amberstructure solution
NMR representativeSelection criteria: closest to the average
NMR ensembleConformer selection criteria: structures with the least restraint violations
Conformers calculated total number: 40 / Conformers submitted total number: 33

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