ソフトウェア | 名称 | 分類 |
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MLPHARE | 位相決定 | NUCLSQ | 精密化 | DENZO | データ削減 | CCP4 | データスケーリング |
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精密化 | 構造決定の手法: 多波長異常分散 / 解像度: 1.65→8 Å / σ(F): 0 / |
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Refine Biso | クラス | Refine-ID | 詳細 | Treatment |
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ALL ATOMSX-RAY DIFFRACTION | TRisotropicALL WATERSX-RAY DIFFRACTION | TRisotropic | | | | | |
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精密化ステップ | サイクル: LAST / 解像度: 1.65→8 Å
| タンパク質 | 核酸 | リガンド | 溶媒 | 全体 |
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原子数 | 0 | 240 | 2 | 61 | 303 |
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拘束条件 | Refine-ID | タイプ | Dev ideal | Dev ideal target |
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X-RAY DIFFRACTION | n_bond_d1.413 | 0.01 | X-RAY DIFFRACTION | n_angle_d2.404 | 0.15 | X-RAY DIFFRACTION | n_planar_d | | X-RAY DIFFRACTION | n_hb_or_metal_coord | | X-RAY DIFFRACTION | n_sugar_bond_it | | X-RAY DIFFRACTION | n_sugar_angle_it | | X-RAY DIFFRACTION | n_phos_bond_it | | X-RAY DIFFRACTION | n_phos_angle_it | | X-RAY DIFFRACTION | n_bond_angle_restr | | X-RAY DIFFRACTION | n_dihedral_angle_restr | | X-RAY DIFFRACTION | n_impr_tor | | X-RAY DIFFRACTION | n_sugar_bond_d | | X-RAY DIFFRACTION | n_sugar_bond_angle_d | | X-RAY DIFFRACTION | n_phos_bond_d1.542 | 0.01 | X-RAY DIFFRACTION | n_phos_bond_angle_d3.045 | 0.15 | X-RAY DIFFRACTION | n_plane_restr | | X-RAY DIFFRACTION | n_chiral_restr | | X-RAY DIFFRACTION | n_singtor_nbd | | X-RAY DIFFRACTION | n_multtor_nbd | | X-RAY DIFFRACTION | n_xhyhbond_nbd | | | | | | | | | | | | | | | | | | | | | |
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ソフトウェア | *PLUS 名称: PROLSQ / 分類: refinement |
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拘束条件 | *PLUS Refine-ID | タイプ | Dev ideal |
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X-RAY DIFFRACTION | p_bond_d0.01 | X-RAY DIFFRACTION | p_angle_d0.015 | X-RAY DIFFRACTION | p_planar_d | X-RAY DIFFRACTION | p_plane_restr | X-RAY DIFFRACTION | p_chiral_restr | | | | | |
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