HETEROGEN CONTINUOUS, UNINTERPRETABLE ELECTRON DENSITY NEAR RESIDUES (5,121,126) IN BOTH SUBUNITS ...HETEROGEN CONTINUOUS, UNINTERPRETABLE ELECTRON DENSITY NEAR RESIDUES (5,121,126) IN BOTH SUBUNITS IS LISTED AS UNL, AN UNKNOWN LIGAND CONTAINING OXYGENS.
Remark 999
SEQUENCE BOTH CHAINS WERE TRUNCATIONS OF THE ORIGINAL SEQUENCE TRUNCATED AT RESIDUE 145, THEN ...SEQUENCE BOTH CHAINS WERE TRUNCATIONS OF THE ORIGINAL SEQUENCE TRUNCATED AT RESIDUE 145, THEN HAVING THE ADDITIONAL RDLINSR, A C-TERMINAL EPITOPE TAG.
解像度: 1.9→50 Å / Num. obs: 24182 / % possible obs: 100 % / 冗長度: 2.18 % / Biso Wilson estimate: 42.13 Å2 / Rmerge(I) obs: 0.086 / Net I/σ(I): 19.58
反射 シェル
解像度: 1.9→1.97 Å / 冗長度: 1.31 % / Rmerge(I) obs: 0.485 / Mean I/σ(I) obs: 1.44 / % possible all: 92.4
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解析
ソフトウェア
名称
バージョン
分類
DENZO
データ削減
SCALEPACK
データスケーリング
SOLVE
位相決定
RESOLVE
モデル構築
REFMAC
5.1.9999
精密化
RESOLVE
位相決定
精密化
構造決定の手法: 単波長異常分散 / 解像度: 1.9→32.96 Å / Cor.coef. Fo:Fc: 0.964 / Cor.coef. Fo:Fc free: 0.931 / SU B: 11.199 / SU ML: 0.157 / TLS residual ADP flag: LIKELY RESIDUAL / 交差検証法: THROUGHOUT / ESU R: 0.16 / ESU R Free: 0.158 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: 1. HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. 2. CHLORINE WAS MODELED SINCE IT OCCURS IN THE CRYSTALLIZATION BUFFER AND RESULTED IN NO RESIDUAL DIFFERENCE DENSITY AT THE SITES. 3. ...詳細: 1. HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. 2. CHLORINE WAS MODELED SINCE IT OCCURS IN THE CRYSTALLIZATION BUFFER AND RESULTED IN NO RESIDUAL DIFFERENCE DENSITY AT THE SITES. 3. CONTINUOUS, UNINTERPRETABLE ELECTRON DENSITY NEAR RESIDUES (5,121,126) IN BOTH SUBUNITS IS LISTED AS UNL, AN UNKNOWN LIGAND CONTAINING OXYGENS.
Rfactor
反射数
%反射
Selection details
Rfree
0.253
1214
5 %
RANDOM
Rwork
0.198
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obs
0.201
23110
96.5 %
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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: 1.2 Å / 溶媒モデル: BABINET MODEL WITH MASK