手法: Simulate annealing, torsion angle dynamics / ソフトェア番号: 1 詳細: A total of 1639 upper distance limits (of which 1431 meaningful), 31 dihedral phi angle constraints and 48 psi angle constraints were measured and used in the structural calculations. 5 ...詳細: A total of 1639 upper distance limits (of which 1431 meaningful), 31 dihedral phi angle constraints and 48 psi angle constraints were measured and used in the structural calculations. 5 stereospecific assignments were also obtained from the analysis of HNHB spectra and 11 through the program GLOMSA.
NMRアンサンブル
コンフォーマー選択の基準: structure with the lowest energy target function 計算したコンフォーマーの数: 30 / 登録したコンフォーマーの数: 30