2jxf
The solution structure of HCV NS4B(40-69)
SAXS 散射曲线 SAXS Profile
P(r) 距离分布 P(r) Distribution
1. 结构基本信息 1. Structure Basics
| 条目编号 entry_id | 2jxf |
| 沉积日期 deposition_date | 2007-11-19 |
| 结构标题 title | The solution structure of HCV NS4B(40-69) |
| 关键词 keywords | ;membrane associated segment, Acetylation, Apoptosis, ATP-binding, Capsid protein, Cytoplasm, Endoplasmic reticulum, Envelope protein, Fusion protein, Glycoprotein, Helicase, Host-virus interaction, Hydrolase, Interferon antiviral system evasion, Lipid droplet, Lipoprotein, Metal-binding, Mitochondrion, Multifunctional enzyme, Nucleotide-binding, Nucleotidyltransferase, Nucleus, Oncogene, Palmitate, Phosphoprotein, Protease, Ribonucleoprotein, RNA replication, RNA-binding, RNA-directed RNA polymerase, Secreted, Serine protease, SH3-binding, Thiol protease, Transcription, Transcription regulation, Transferase, Transmembrane, Ubl conjugation, Viral nucleoprotein, Virion, Zinc, VIRAL PROTEIN, MEMBRANE PROTEIN ;; VIRAL PROTEIN, MEMBRANE PROTEIN |
| 实验方法 method | SOLUTION NMR |
2. SAXS 参数 (CRYSOL 理论计算) 2. SAXS Parameters (CRYSOL)
| 回转半径 Rg (Guinier) rg_guinier | 12.86 Å |
| 回转半径 Rg (电子) rg_electron | 13.17 Å |
| 零角强度 I(0) i0 | 141812000.00 |
| 分子量 molecular_weight | 107970.0 kDa |
| 排除体积 excluded_volume | 137680 ų |
| 包络体积 envelope_volume | 15487 ų |
| 水化壳体积 shell_volume | 9357 ų |
| 包络直径 envelope_diameter | 57.0 Å |
| 壳层 Rg shell_rg | 19.89 Å |
| 包络 Rg envelope_rg | 16.51 Å |
| 形状 Rg shape_rg | 13.11 Å |
| 总 Rg total_rg | 13.61 Å |
| 总原子数 total_atoms | 15090 |
| 残基数 n_residues | 900 |
| 球谐函数阶数 n_harmonics | 20 |
| q 范围 q_range | — – 0.5000 Å−1 |
| 数据点数 n_points | 101 |
| 壳层类型 shell_type | directional |
| 溶剂电子密度 solvent_density | 0.3340 e/ų |
| 壳层衬度 contrast_shell | 0.0300 e/ų |
| CRYSOL 版本 crysol_version | 4.1.3 |
3. P(r) 距离分布 (GNOM 反演) 3. P(r) Analysis (GNOM)
| 最大尺寸 Dmax dmax | 50.9 Å |
| Rg (实空间) rg_real | 13.32 Å |
| Rg 误差 (实空间) rg_real_error | 0.67 Å |
| I(0) (实空间) i0_real | 1.4180e+08 |
| I(0) 误差 (实空间) i0_real_error | 1.8160e+06 |
| Rg (倒空间) rg_reciprocal | 13.29 Å |
| I(0) (倒空间) i0_reciprocal | 141800000.0000 |
| 解质量估计 total_estimate | 0.5453 |
| 解质量评级 solution_quality | REASONABLE a REASONABLE solution |
| P(r) 峰数 n_peaks | 4 |
| 主峰位置 r_peak_primary | 7.1 Å |
| 偏度 Skewness skewness | 0.693 |
| 峰度 Kurtosis kurtosis | -0.349 |
| 角度范围 angular_range | — – 0.5000 Å−1 |
| 当前正则化参数 α current_alpha | 0.0000 |
| 最高正则化参数 α highest_alpha | 6939.0000 |
| 实空间数据点数 n_real_points | 80 |
| GNOM 版本 gnom_version | 4.1.3 |
| 质量判据 quality_criteria | AN1: 0.000; Oscil: 0.028; Stabil: 0.999; Sysdev: 1.000; Positv: 1.000; Valcen: 0.001; Smooth: 0.000 |