解像度: 1.08→1.1 Å / 冗長度: 1.73 % / Rmerge(I) obs: 0.519 / Mean I/σ(I) obs: 1.51 / Num. unique all: 2763 / % possible all: 78.5
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解析
ソフトウェア
名称
分類
MAR345
データ収集
XDS
データ削減
SOLVE
位相決定
SHELXL-97
精密化
XDS
データスケーリング
精密化
構造決定の手法: 多波長異常分散 / 解像度: 1.13→10 Å / Num. parameters: 15000 / Num. restraintsaints: 18590 / Isotropic thermal model: anisotropic / 交差検証法: free R / σ(F): -3 / σ(I): -3 StereochEM target val spec case: MOEWS & KRETSINGER, J.MOL.BIOL.91(1973)201-228 立体化学のターゲット値: Engh & Huber 詳細: structure was solved with MAD on a Seleno-Met crystal at 2A. This entry is based on the high resolution data measured at 0.95372A wavelength. Anisotropic scaling applied by the method of ...詳細: structure was solved with MAD on a Seleno-Met crystal at 2A. This entry is based on the high resolution data measured at 0.95372A wavelength. Anisotropic scaling applied by the method of parkin, MOEZZI & HOPE, J.APPL.CRYST.28(1995)53-56
Rfactor
反射数
%反射
Selection details
Rfree
0.183
2781
5 %
RANDOM
Rwork
0.137
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all
0.139
55631
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obs
0.139
55631
99.9 %
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Refine analyze
Num. disordered residues: 15 / Occupancy sum hydrogen: 1445.46 / Occupancy sum non hydrogen: 1605.46