2dun
Solution structure of BRCT domain of DNA polymerase mu
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 | 2dun |
| 沉积日期 deposition_date | 2006-07-25 |
| 结构标题 title | Solution structure of BRCT domain of DNA polymerase mu |
| 关键词 keywords | ;3 layers a/b/a, parallel beta-sheet of 4 strands, non-homologous end jonting, somatic hypermutation, V(D)J recombination, Structural Genomics, NPPSFA, National Project on Protein Structural and Functional Analyses, RIKEN Structural Genomics/Proteomics Initiative, RSGI, TRANSFERASE ;; TRANSFERASE |
| 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 | 20.84 Å |
| 回转半径 Rg (电子) rg_electron | 20.80 Å |
| 零角强度 I(0) i0 | 1211230000.00 |
| 分子量 molecular_weight | 279700.0 kDa |
| 排除体积 excluded_volume | 344840 ų |
| 包络体积 envelope_volume | 112710 ų |
| 水化壳体积 shell_volume | 30289 ų |
| 包络直径 envelope_diameter | 112.9 Å |
| 壳层 Rg shell_rg | 36.67 Å |
| 包络 Rg envelope_rg | 35.24 Å |
| 形状 Rg shape_rg | 20.79 Å |
| 总 Rg total_rg | 21.25 Å |
| 总原子数 total_atoms | 38860 |
| 残基数 n_residues | 2660 |
| 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 | 104.2 Å |
| Rg (实空间) rg_real | 21.73 Å |
| Rg 误差 (实空间) rg_real_error | 1.53 Å |
| I(0) (实空间) i0_real | 1.2110e+09 |
| I(0) 误差 (实空间) i0_real_error | 1.9630e+07 |
| Rg (倒空间) rg_reciprocal | 21.56 Å |
| I(0) (倒空间) i0_reciprocal | 1211000000.0000 |
| 解质量估计 total_estimate | 0.4076 |
| 解质量评级 solution_quality | SUSPICIOUS a SUSPICIOUS solution |
| P(r) 峰数 n_peaks | 2 |
| 主峰位置 r_peak_primary | 18.1 Å |
| 偏度 Skewness skewness | 1.152 |
| 峰度 Kurtosis kurtosis | 1.034 |
| 角度范围 angular_range | — – 0.3800 Å−1 |
| 当前正则化参数 α current_alpha | 0.0001 |
| 最高正则化参数 α highest_alpha | 1008000.0000 |
| 实空间数据点数 n_real_points | 70 |
| GNOM 版本 gnom_version | 4.1.3 |
| 质量判据 quality_criteria | AN1: 0.000; Oscil: 0.003; Stabil: 1.000; Sysdev: 0.095; Positv: 1.000; Valcen: 0.000; Smooth: 1.000 |
4. 晶体学与实验 4. Crystallography & Experiment
5. 实体与聚合体信息 (1)
6. 折叠分类 (SCOP + CATH) 1 domains
CATH v4.4 (1 domains)
| 结构域编号 domain_id | 2dunA01 |
| 类 Class class | 3 — Alpha Beta |
| 架构 Architecture architecture | 40 — 3-Layer(aba) Sandwich |
| 拓扑 Topology topology | 50 — Rossmann fold |
| 同源超家族 H-superfamily homologous superfamily | 10190 — BRCT domain |