- PDB-3o1n: 1.03 Angstrom Crystal Structure of Q236A Mutant Type I Dehydroqui... -
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基本情報
登録情報
データベース: PDB / ID: 3o1n
タイトル
1.03 Angstrom Crystal Structure of Q236A Mutant Type I Dehydroquinate Dehydratase (aroD) from Salmonella typhimurium
要素
3-dehydroquinate dehydratase
キーワード
LYASE / Structural Genomics / Center for Structural Genomics of Infectious Diseases / CSGID / TIM barrel / dehydratase
機能・相同性
機能・相同性情報
3,4-dihydroxybenzoate biosynthetic process / 3-dehydroquinate dehydratase / 3-dehydroquinate dehydratase activity / chorismate biosynthetic process / aromatic amino acid family biosynthetic process / amino acid biosynthetic process 類似検索 - 分子機能
3-dehydroquinate dehydratase, active site / Dehydroquinase class I active site. / 3-dehydroquinate dehydratase type I / Type I 3-dehydroquinase / Aldolase class I / Aldolase-type TIM barrel / TIM Barrel / Alpha-Beta Barrel / Alpha Beta 類似検索 - ドメイン・相同性
解像度: 1.03→26.62 Å / Cor.coef. Fo:Fc: 0.979 / Cor.coef. Fo:Fc free: 0.974 / SU B: 0.763 / SU ML: 0.018 Isotropic thermal model: Anisotropically refined individual B-factors 交差検証法: THROUGHOUT / ESU R Free: 0.028 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD / 詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
Rfactor
反射数
%反射
Selection details
Rfree
0.16161
9868
5 %
RANDOM
Rwork
0.14024
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-
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all
0.14132
187094
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-
obs
0.14132
187094
92.63 %
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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