BMRB Entry 18625

Name: NMR Structure of the Self-Complementary 10 mer DNA Oligonucleotide 5&#039;-GGATATATCC-3&#039;.
Published: 2013-01-22

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PDB ID: 2lwg
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR18625
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Nicholas Rego and David Koes
3Dmol.js: molecular visualization with WebGL
Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

NMR Structure of the Self-Complementary 10 mer DNA Oligonucleotide 5'-GGATATATCC-3'.

Deposition date:

2012-07-31

Original release date:

2013-01-22

Authors:

Rettig, Michael; Germann, Markus; Wilson, W. David; Wang, Shuo

Citation:

Citation: Rettig, Michael; Germann, Markus; Wang, Shuo; Wilson, W. David. "Molecular basis for sequence-dependent induced DNA bending." Chembiochem 14, 323-331 (2013).
PubMed: 23355266

Assembly members:

Assembly members:
DNA_(5'-D(*GP*GP*AP*TP*AP*TP*AP*TP*CP*C)-3')_, polymer, 10 residues, 3044.042 Da.

Natural source:

Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available

Experimental source:

Experimental source: Production method: chemical synthesis

Entity Sequences (FASTA):

Entity Sequences (FASTA):
DNA_(5'-D(*GP*GP*AP*TP*AP*TP*AP*TP*CP*C)-3')_: GGATATATCC

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
1H chemical shifts	200

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	GGATATATCC, 1	1
2	GGATATATCC, 2	1

Entities:

Entity 1, GGATATATCC, 1 10 residues - 3044.042 Da.

1

DG

DA

DT

DA

DT

DA

DT

DC

Samples:

sample_1_D2O: GGATATATCC 0.9 mM

sample_1_H2O: GGATATATCC 0.9 mM

sample_1_Pf1: GGATATATCC 1.2 mM; Pf1 phage 11 mg/mL

sample_conditions_1: pH: 7; pressure: 1 atm; temperature: 278 K

Experiments:

Name	Sample	Sample state	Sample conditions
2D 1H-1H NOESY	sample_1_D2O	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_1_H2O	isotropic	sample_conditions_1
2D DQF-COSY	sample_1_D2O	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_1_Pf1	anisotropic	sample_conditions_1
2D 1H-13C HSQC aliphatic	sample_1_Pf1	anisotropic	sample_conditions_1
2D 1H-13C HSQC aromatic	sample_1_Pf1	anisotropic	sample_conditions_1

Software:

AMBER v9, Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman - structure solution

NMR spectrometers:

Bruker Avance 600 MHz
Bruker Avance 500 MHz