residue 92, which is modeled as Ala in the current structure, is modified by unnatural amino acid ...residue 92, which is modeled as Ala in the current structure, is modified by unnatural amino acid biprimidine Ala.
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実験情報
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実験
実験
手法: X線回折 / 使用した結晶の数: 1
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試料調製
結晶
マシュー密度: 2 Å3/Da / 溶媒含有率: 38.45 %
結晶化
温度: 277 K / 手法: microbatch under oil / pH: 6.5 詳細: protein buffer: 10 mM Tris HCl (pH 8). Precipitation cocktail: 100 MM NA CACODYLATE (PH 6.5), 5 mM FeCl2, 15% PEG 3350 Microbatch under oil, temperature 277K
解像度: 1.4→31.021 Å / SU ML: 0.18 / 交差検証法: THROUGHOUT / σ(F): 1.34 / σ(I): 1.3 / 位相誤差: 13.94 / 立体化学のターゲット値: ML 詳細: the electron density near Cys-351 was modeled as As ion, however, Fe2+ could be another possibility
Rfactor
反射数
%反射
Selection details
Rfree
0.1662
6183
10.06 %
RANDOM
Rwork
0.1349
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all
0.1394
61546
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obs
0.1382
61460
99.86 %
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溶媒の処理
減衰半径: 0.83 Å / VDWプローブ半径: 1.1 Å / 溶媒モデル: FLAT BULK SOLVENT MODEL / Bsol: 40.338 Å2 / ksol: 0.396 e/Å3