0.55 mM [U-15N] Siz1, 20 mM potassium phosphate, 300 mM sodium chloride, 3 mM DTT, 92% H2O/8% D2O
92% H2O/8% D2O
2
0.6 mM [U-13C; U-15N] Siz1, 20 mM potassium phosphate, 300 mM sodium chloride, 3 mM DTT, 92% H2O/8% D2O
92% H2O/8% D2O
3
0.69 mM [U-13C; U-15N] Siz1, 20 mM potassium phosphate, 300 mM sodium chloride, 3 mM DTT, 100% D2O
100% D2O
試料
濃度 (mg/ml)
構成要素
Isotopic labeling
Solution-ID
0.55mM
Siz1
[U-15N]
1
20mM
potassiumphosphate
1
300mM
sodiumchloride
1
3mM
DTT
1
0.6mM
Siz1
[U-13C; U-15N]
2
20mM
potassiumphosphate
2
300mM
sodiumchloride
2
3mM
DTT
2
0.69mM
Siz1
[U-13C; U-15N]
3
20mM
potassiumphosphate
3
300mM
sodiumchloride
3
3mM
DTT
3
試料状態
pH: 6.1 / 圧: ambient / 温度: 283 K
-
NMR測定
NMRスペクトロメーター
タイプ: Bruker DMX / 製造業者: Bruker / モデル: DMX / 磁場強度: 750 MHz
-
解析
NMR software
名称
バージョン
開発者
分類
XwinNMR
3.1
BrukerBiospin
collection
NMRPipe
releasedatFeb10, 2006
Delaglio, Grzesiek, Vuister, Zhu, PfeiferandBax
解析
TALOS
2003.027.13.05
Cornilescu, DelaglioandBax
データ解析
Sparky
3.113
Goddard
peakpicking
Sparky
3.113
Goddard
chemicalshiftassignment
PIPP
4.3.6
Garrett
peakpicking
PIPP
4.3.6
Garrett
chemicalshiftassignment
CYANA
2.1
Guntert, MumenthalerandWuthrich
構造決定
CYANA
2.1
Guntert, MumenthalerandWuthrich
精密化
AQUA
3.2
Rullmann, DoreleijersandKaptein
データ解析
ProcheckNMR
3.5.4
LaskowskiandMacArthur
データ解析
精密化
手法: torsion angle dynamics / ソフトェア番号: 1
NMR constraints
NOE constraints total: 2009 / NOE intraresidue total count: 586 / NOE long range total count: 283 / NOE medium range total count: 528 / NOE sequential total count: 612 / Hydrogen bond constraints total count: 106 / Protein chi angle constraints total count: 37 / Protein other angle constraints total count: 9 / Protein phi angle constraints total count: 73 / Protein psi angle constraints total count: 78
代表構造
選択基準: fewest violations
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