手法: simulated annealing / ソフトェア番号: 1 詳細: NOE, Dihedral angles, RDC and symmetry restraints, explicit solvent refinement and full electrostatics
NMR constraints
NOE constraints total: 1045 / NOE intraresidue total count: 260 / NOE long range total count: 94 / NOE medium range total count: 315 / NOE sequential total count: 376
代表構造
選択基準: lowest energy
NMRアンサンブル
コンフォーマー選択の基準: structures with the lowest energy 計算したコンフォーマーの数: 200 / 登録したコンフォーマーの数: 20 / Maximum lower distance constraint violation: 0.2 Å / Maximum upper distance constraint violation: 0.5 Å