NO RESTRAINT VIOLATIONS LESS THAN 0.2 ANGSTROMS AND MIMINUM ENERGY LESS THAN 115.0 KCAL/MOL BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE: 1
代表モデル
モデル #1
minimized average structure
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要素
#1: タンパク質
NeurotoxinCn11 / CN12
分子量: 7154.865 Da / 分子数: 1 / 由来タイプ: 天然 詳細: TOXIN OBTAINED DIRECTLY FROM VENOM OF CENTRUROIDES NOXIUS. ACTIVITY IS VERY LOW, HOWEVER CN12 HAS SOME REQUIREMENTS FOR BEING A VERY ACTIVE TOXIN. 由来: (天然) Centruroides noxius (サソリ) / Secretion: VENOM / 参照: UniProt: P63019
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実験情報
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実験
実験
手法: 溶液NMR
NMR実験
Conditions-ID
Experiment-ID
Solution-ID
タイプ
1
1
1
DQF COSY, 2D TOCSY, AND 2D NOSEY
2
2
2
DQF-COSY, 2D TOCSY, AND 2D NOESY
NMR実験の詳細
Text: THE STRUCTURE WAS DETERMINED USING HOMONUCLEAR 1H-1H 2D NMR ON THE NATURAL TOXIN EXTRACTED FROM THE SCORPION VENOM
コンフォーマー選択の基準: NO RESTRAINT VIOLATIONS LESS THAN 0.2 ANGSTROMS AND MIMINUM ENERGY LESS THAN 115.0 KCAL/MOL BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE: 1 計算したコンフォーマーの数: 250 / 登録したコンフォーマーの数: 19