COBALT (II) ION (CO): COBALT MOST LIKELY GIVEN ANOMALOUS DIFFRACTION AT 2 WAVELENGTHS GLYCEROL (GOL) ...COBALT (II) ION (CO): COBALT MOST LIKELY GIVEN ANOMALOUS DIFFRACTION AT 2 WAVELENGTHS GLYCEROL (GOL): TENTATIVE - SOME DENSITY IN THE ACTIVE SITE
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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: 13
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試料調製
結晶
マシュー密度: 2.7 Å3/Da / 溶媒含有率: 54 % 解説: STRUCTURE FILE CONTAINS FREER-REFLECTIONS TO 0.9 A (NO ACTUAL DATA).ONE CONSISTENT FREER SET WAS USED FOR SEVERAL DATA SETS.
解像度: 1.2→70.77 Å / Cor.coef. Fo:Fc: 0.978 / Cor.coef. Fo:Fc free: 0.972 / SU B: 0.59 / SU ML: 0.013 / 交差検証法: THROUGHOUT / ESU R: 0.025 / ESU R Free: 0.025 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.U VALUES REFINED INDIVIDUALLY.
Rfactor
反射数
%反射
Selection details
Rfree
0.12788
7247
5 %
RANDOM
Rwork
0.10998
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obs
0.11089
136929
99.97 %
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溶媒の処理
イオンプローブ半径: 0.8 Å / 減衰半径: 0.8 Å / VDWプローブ半径: 1.4 Å / 溶媒モデル: BABINET MODEL WITH MASK