1ksl
STRUCTURE OF RSUA
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 | 1ksl |
| 沉积日期 deposition_date | 2002-01-13 |
| 结构标题 title | STRUCTURE OF RSUA |
| 关键词 keywords | Pseudouridine Synthase, rsuA, Montreal-Kingston Bacterial Structural Genomics Initiative, BSGI, Structural Genomics, LYASE; LYASE |
| 实验方法 method | X-RAY DIFFRACTION |
2. SAXS 参数 (CRYSOL 理论计算) 2. SAXS Parameters (CRYSOL)
| 回转半径 Rg (Guinier) rg_guinier | 24.10 Å |
| 回转半径 Rg (电子) rg_electron | 23.94 Å |
| 零角强度 I(0) i0 | 13152100.00 |
| 分子量 molecular_weight | 26193.0 kDa |
| 排除体积 excluded_volume | 32285 ų |
| 包络体积 envelope_volume | 42060 ų |
| 水化壳体积 shell_volume | 16901 ų |
| 包络直径 envelope_diameter | 84.3 Å |
| 壳层 Rg shell_rg | 27.68 Å |
| 包络 Rg envelope_rg | 24.01 Å |
| 形状 Rg shape_rg | 23.96 Å |
| 总 Rg total_rg | 24.37 Å |
| 总原子数 total_atoms | 1834 |
| 残基数 n_residues | 228 |
| 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 | 83.1 Å |
| Rg (实空间) rg_real | 24.48 Å |
| Rg 误差 (实空间) rg_real_error | 0.79 Å |
| I(0) (实空间) i0_real | 1.3150e+07 |
| I(0) 误差 (实空间) i0_real_error | 1.8710e+05 |
| Rg (倒空间) rg_reciprocal | 24.39 Å |
| I(0) (倒空间) i0_reciprocal | 13150000.0000 |
| 解质量估计 total_estimate | 0.5744 |
| 解质量评级 solution_quality | REASONABLE a REASONABLE solution |
| P(r) 峰数 n_peaks | 2 |
| 主峰位置 r_peak_primary | 20.8 Å |
| 偏度 Skewness skewness | 0.616 |
| 峰度 Kurtosis kurtosis | -0.307 |
| 角度范围 angular_range | — – 0.3300 Å−1 |
| 当前正则化参数 α current_alpha | 0.0000 |
| 最高正则化参数 α highest_alpha | 3125000.0000 |
| 实空间数据点数 n_real_points | 65 |
| GNOM 版本 gnom_version | 4.1.3 |
| 质量判据 quality_criteria | AN1: 0.000; Oscil: 0.632; Stabil: 1.000; Sysdev: 0.101; Positv: 1.000; Valcen: 0.470; Smooth: 0.795 |
4. 晶体学与实验 4. Crystallography & Experiment
5. 实体与聚合体信息 (3)
6. 折叠分类 (SCOP + CATH) 4 domains
SCOP 2.08 (2 domains)
| 结构域编号 domain_id | d1ksla3 |
| 类 Class class | d — Alpha and beta proteins (a+b) |
| 折叠类型 Fold fold | d.66 — Alpha-L RNA-binding motif |
| 超家族 Superfamily superfamily | d.66.1 — Alpha-L RNA-binding motif |
| 家族 Family family | d.66.1.5 — Pseudouridine synthase RsuA N-terminal domain |
| 结构域编号 domain_id | d1ksla4 |
| 类 Class class | d — Alpha and beta proteins (a+b) |
| 折叠类型 Fold fold | d.265 — Pseudouridine synthase |
| 超家族 Superfamily superfamily | d.265.1 — Pseudouridine synthase |
| 家族 Family family | d.265.1.3 — Pseudouridine synthase RsuA/RluD |
CATH v4.4 (2 domains)
| 结构域编号 domain_id | 1kslA01 |
| 类 Class class | 3 — Alpha Beta |
| 架构 Architecture architecture | 10 — Roll |
| 拓扑 Topology topology | 290 — Structural Genomics Hypothetical 15.5 Kd Protein In mrcA-pckA Intergenic Region; Chain A |
| 同源超家族 H-superfamily homologous superfamily | 10 — RNA-binding S4 domain |
| 结构域编号 domain_id | 1kslA02 |
| 类 Class class | 3 — Alpha Beta |
| 架构 Architecture architecture | 30 — 2-Layer Sandwich |
| 拓扑 Topology topology | 2350 — Pseudouridine synthase |
| 同源超家族 H-superfamily homologous superfamily | 10 — Pseudouridine synthase |