1 mM Talin c-terminal actin binding site (ABS3), 90% H2O/10% D2O
90% H2O/10% D2O
2
1 mM [U-15N] Talin c-terminal actin binding site (ABS3), 90% H2O/10% D2O
90% H2O/10% D2O
3
1 mM [U-13C; U-15N] Talin c-terminal actin binding site (ABS3), 90% H2O/10% D2O
90% H2O/10% D2O
試料
濃度 (mg/ml)
構成要素
Isotopic labeling
Solution-ID
1mM
Talin c-terminal actin binding site (ABS3)
1
1mM
Talin c-terminal actin binding site (ABS3)
[U-15N]
2
1mM
Talin c-terminal actin binding site (ABS3)
[U-13C; U-15N]
3
試料状態
イオン強度: 50 / pH: 6 / 圧: ambient / 温度: 318 K
-
NMR測定
NMRスペクトロメーター
タイプ
製造業者
モデル
磁場強度 (MHz)
Spectrometer-ID
Bruker DRX
Bruker
DRX
800
1
Bruker DRX
Bruker
DRX
600
2
Bruker DRX
Bruker
DRX
600
3
-
解析
NMR software
名称
バージョン
開発者
分類
ARIA
1.2
Linge, O'DonoghueandNilges
構造決定
ARIA
1.2
Linge, O'DonoghueandNilges
精密化
CYANA
2.1
Guntert, MumenthalerandWuthrich
chemicalshiftassignment
CYANA
2.1
Guntert, MumenthalerandWuthrich
chemicalshiftcalculation
CYANA
2.1
Guntert, MumenthalerandWuthrich
構造決定
TopSpin
BrukerBiospin
collection
TopSpin
BrukerBiospin
解析
CcpNmr Analysis
11
CCPN
peakpicking
CcpNmr Analysis
11
CCPN
chemicalshiftassignment
TALOS
Cornilescu, DelaglioandBax
geometryoptimization
精密化
手法: simulated annealing, molecular dynamics, torsion angle dynamics ソフトェア番号: 1 詳細: Final Structures refined in explicit water bath as implemented in Aria 1.2/CNS 1.1. 20 lowest energy structures selected from water refinement., CNS, Initial structures generated with Cyana
代表構造
選択基準: lowest energy
NMRアンサンブル
コンフォーマー選択の基準: structures with the least restraint violations 計算したコンフォーマーの数: 100 / 登録したコンフォーマーの数: 20