- PDB-3dd8: Carbonic anhydrase inhibitors. Interaction of the antitumor sulfa... -
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基本情報
登録情報
データベース: PDB / ID: 3dd8
タイトル
Carbonic anhydrase inhibitors. Interaction of the antitumor sulfamate EMD-486019 with twelve mammalian isoforms: kinetic and X-Ray crystallographic studies
THE LIGAND 2C7 IS NEW ANTITUMOR SULFAMATE AND CAN BE ALSO CALLED AS EMD486019.
配列の詳細
THE NUMBER 126 IS SIMPLY SKIPPED IN THE NUMBERING. THE GAP IS IN THE SEQUENCE NUMBERING OF MODEL ...THE NUMBER 126 IS SIMPLY SKIPPED IN THE NUMBERING. THE GAP IS IN THE SEQUENCE NUMBERING OF MODEL 1CA2, THAT IS THE STARTING MODEL FOR ALL CA2 STRUCTURES.
解像度: 1.9→14.59 Å / Cor.coef. Fo:Fc: 0.908 / Cor.coef. Fo:Fc free: 0.874 / 交差検証法: THROUGHOUT / ESU R: 0.209 / ESU R Free: 0.182 / 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
0.25586
920
5.1 %
RANDOM
Rwork
0.20523
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obs
0.20782
17201
93.1 %
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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