Text: This structure was determined using standard 3D heteronuclear techniques. Assignments were derived from HNCACB, CBCACONH, CBHD, CBHE, HCCH-TOCSY, HCC-TOCSY and CCC-TOCSY experiments
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試料調製
詳細
内容: 0.8 mM Ste11 SAM domain, U-15N,13C 溶媒系: 20 mM sodium phosphate buffer, 500 mM sodium chloride, 0.03% sodium azide, 90% H2O, 10% D2O
試料状態
イオン強度: 500 mM sodium chloride / pH: 6.8 / 圧: ambient / 温度: 293 K
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NMR測定
放射
プロトコル: SINGLE WAVELENGTH / 単色(M)・ラウエ(L): M
放射波長
相対比: 1
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
Varian INOVA
Varian
INOVA
500
1
Varian INOVA
Varian
INOVA
600
2
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解析
NMR software
名称
バージョン
開発者
分類
NMRPipe
2.1
Delaglio
解析
X-PLOR
NIH
Brunger, Clore
構造決定
NMRView
5
Johnson
データ解析
X-PLOR
NIH
Brunger, Clore
精密化
精密化
手法: simulated annealing from an extended starting structure ソフトェア番号: 1 詳細: 971 NOE restraints from a simultaneous 13C/15N NOESY in 10% D2O, 69 NOE restraints from a 2D NOESY in 99% D2O, 48 hydrogen bonds restraints and 59 pairs of phi/psi dihedral restraints from ...詳細: 971 NOE restraints from a simultaneous 13C/15N NOESY in 10% D2O, 69 NOE restraints from a 2D NOESY in 99% D2O, 48 hydrogen bonds restraints and 59 pairs of phi/psi dihedral restraints from chemical shifts using the TALOS method
代表構造
選択基準: no violations > 0.5 a, lowest energy, good geometry