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3D Structure of Lumazine Synthase from Candida albicans
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 | 2jfb |
| 沉积日期 deposition_date | 2007-01-30 |
| 结构标题 title | 3D Structure of Lumazine Synthase from Candida albicans |
| 关键词 keywords | TRANSFERASE, CANDIDA ALBICANS, LUMAZINE SYNTHASE, RIBOFLAVIN BIOSYNTHESIS; TRANSFERASE |
| 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 | 43.73 Å |
| 回转半径 Rg (电子) rg_electron | 43.07 Å |
| 零角强度 I(0) i0 | 900203000.00 |
| 分子量 molecular_weight | 256110.0 kDa |
| 排除体积 excluded_volume | 324350 ų |
| 包络体积 envelope_volume | 427360 ų |
| 水化壳体积 shell_volume | 80714 ų |
| 包络直径 envelope_diameter | 142.9 Å |
| 壳层 Rg shell_rg | 50.16 Å |
| 包络 Rg envelope_rg | 41.92 Å |
| 形状 Rg shape_rg | 43.06 Å |
| 总 Rg total_rg | 43.42 Å |
| 总原子数 total_atoms | 18003 |
| 残基数 n_residues | 2291 |
| 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 | 137.7 Å |
| Rg (实空间) rg_real | 43.54 Å |
| Rg 误差 (实空间) rg_real_error | 0.99 Å |
| I(0) (实空间) i0_real | 9.0020e+08 |
| I(0) 误差 (实空间) i0_real_error | 1.4190e+07 |
| Rg (倒空间) rg_reciprocal | 43.73 Å |
| I(0) (倒空间) i0_reciprocal | 900400000.0000 |
| 解质量估计 total_estimate | 0.8997 |
| 解质量评级 solution_quality | GOOD a GOOD solution |
| P(r) 峰数 n_peaks | 1 |
| 主峰位置 r_peak_primary | 53.5 Å |
| 偏度 Skewness skewness | 0.145 |
| 峰度 Kurtosis kurtosis | -0.556 |
| 角度范围 angular_range | — – 0.1800 Å−1 |
| 当前正则化参数 α current_alpha | 0.0000 |
| 最高正则化参数 α highest_alpha | 111600000.0000 |
| 实空间数据点数 n_real_points | 37 |
| GNOM 版本 gnom_version | 4.1.3 |
| 质量判据 quality_criteria | AN1: 0.000; Oscil: 0.935; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.988; Smooth: 0.898 |
4. 晶体学与实验 4. Crystallography & Experiment
5. 实体与聚合体信息 (4)
6. 折叠分类 (SCOP + CATH) 30 domains
SCOP 2.08 (15 domains)
| 结构域编号 domain_id | d2jfba_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbb_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbc_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbd_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbe_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbf_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbg_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbh_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbi_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbj_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbk_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbl_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbm_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbn_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
| 结构域编号 domain_id | d2jfbo_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.16 — Lumazine synthase |
| 超家族 Superfamily superfamily | c.16.1 — Lumazine synthase |
| 家族 Family family | c.16.1.1 — Lumazine synthase |
CATH v4.4 (15 domains)
| 结构域编号 domain_id | 2jfbA00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbB00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbC00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbD00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbE00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbF00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbG00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbH00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbI00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbJ00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbK00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbL00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbM00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbN00 |
| 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 | 960 — Lumazine/riboflavin synthase |
| 结构域编号 domain_id | 2jfbO00 |
| 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 | 960 — Lumazine/riboflavin synthase |