DNA (5'-D(*GP*CP*GP*CP*GP*AP*AP*AP*CP*TP*GP*TP*TP*TP*CP*GP*CP*GP*C)-3')
分子量: 5821.759 Da / 分子数: 1 / 断片: FRAGMENT OF E2F BINDING DNA / 由来タイプ: 合成 詳細: The sequence is formed by adding CTG loop to ends of ds(GCGCGAAA:TTTCGCGC), which occurs naturally in humans.
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実験情報
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実験
実験
手法: 溶液NMR
NMR実験
Conditions-ID
Experiment-ID
Solution-ID
タイプ
1
1
1
2D NOESY
1
2
2
2D NOESY
NMR実験の詳細
Text: Solvent suppression was realized by WATERGATE method.
タイプ: Bruker DMX / 製造業者: Bruker / モデル: DMX / 磁場強度: 500 MHz
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解析
NMR software
名称
バージョン
開発者
分類
XwinNMR
1.1
Bruker
collection
IRMA
0.1
AlexandreBonvin
iterativematrixrelaxation
GROMOS
96
W.F.vanGunsteren
精密化
精密化
手法: Molecular Dynamics with Particle-Particle Particle-Mesh method; Iterative Relaxation Matrix Approach with generalized order parameters ソフトェア番号: 1 詳細: Initial structure for model 1 is A-DNA, while that for model 2 is B-DNA. First we applied 640ps free MD with 18 Na+ counterions and 2789 waters for A-DNA and 2303 waters for B-DNA. Then we ...詳細: Initial structure for model 1 is A-DNA, while that for model 2 is B-DNA. First we applied 640ps free MD with 18 Na+ counterions and 2789 waters for A-DNA and 2303 waters for B-DNA. Then we applied 4 cycles of IRMA with 174 NOE restraints and 19 hydrogen bond restraints
NMRアンサンブル
コンフォーマー選択の基準: all calculated structures submitted 計算したコンフォーマーの数: 2 / 登録したコンフォーマーの数: 2