1hx5
Crystal structure of M. tuberculosis chaperonin-10
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 | 1hx5 |
| 沉积日期 deposition_date | 2001-01-11 |
| 结构标题 title | Crystal structure of M. tuberculosis chaperonin-10 |
| 关键词 keywords | ;beta barrel, mobile loop, Structural Genomics, PSI, Protein Structure Initiative, TB Structural Genomics Consortium, TBSGC, CHAPERONE ;; CHAPERONE |
| 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 | 29.04 Å |
| 回转半径 Rg (电子) rg_electron | 28.20 Å |
| 零角强度 I(0) i0 | 55552100.00 |
| 分子量 molecular_weight | 61019.0 kDa |
| 排除体积 excluded_volume | 77747 ų |
| 包络体积 envelope_volume | 107050 ų |
| 水化壳体积 shell_volume | 31949 ų |
| 包络直径 envelope_diameter | 84.3 Å |
| 壳层 Rg shell_rg | 35.96 Å |
| 包络 Rg envelope_rg | 26.94 Å |
| 形状 Rg shape_rg | 28.19 Å |
| 总 Rg total_rg | 29.10 Å |
| 总原子数 total_atoms | 4312 |
| 残基数 n_residues | 574 |
| 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 | 85.7 Å |
| Rg (实空间) rg_real | 28.92 Å |
| Rg 误差 (实空间) rg_real_error | 0.61 Å |
| I(0) (实空间) i0_real | 5.5550e+07 |
| I(0) 误差 (实空间) i0_real_error | 8.6200e+05 |
| Rg (倒空间) rg_reciprocal | 28.98 Å |
| I(0) (倒空间) i0_reciprocal | 55550000.0000 |
| 解质量估计 total_estimate | 0.9059 |
| 解质量评级 solution_quality | EXCELLENT a EXCELLENT solution |
| P(r) 峰数 n_peaks | 1 |
| 主峰位置 r_peak_primary | 40.5 Å |
| 偏度 Skewness skewness | 0.076 |
| 峰度 Kurtosis kurtosis | -0.699 |
| 角度范围 angular_range | — – 0.2750 Å−1 |
| 当前正则化参数 α current_alpha | 0.0000 |
| 最高正则化参数 α highest_alpha | 13790000.0000 |
| 实空间数据点数 n_real_points | 56 |
| GNOM 版本 gnom_version | 4.1.3 |
| 质量判据 quality_criteria | AN1: 0.000; Oscil: 0.988; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 1.000; Smooth: 0.811 |
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) 14 domains
SCOP 2.08 (7 domains)
| 结构域编号 domain_id | d1hx5a_ |
| 类 Class class | b — All beta proteins |
| 折叠类型 Fold fold | b.35 — GroES-like |
| 超家族 Superfamily superfamily | b.35.1 — GroES-like |
| 家族 Family family | b.35.1.1 — GroES |
| 结构域编号 domain_id | d1hx5b_ |
| 类 Class class | b — All beta proteins |
| 折叠类型 Fold fold | b.35 — GroES-like |
| 超家族 Superfamily superfamily | b.35.1 — GroES-like |
| 家族 Family family | b.35.1.1 — GroES |
| 结构域编号 domain_id | d1hx5c_ |
| 类 Class class | b — All beta proteins |
| 折叠类型 Fold fold | b.35 — GroES-like |
| 超家族 Superfamily superfamily | b.35.1 — GroES-like |
| 家族 Family family | b.35.1.1 — GroES |
| 结构域编号 domain_id | d1hx5d_ |
| 类 Class class | b — All beta proteins |
| 折叠类型 Fold fold | b.35 — GroES-like |
| 超家族 Superfamily superfamily | b.35.1 — GroES-like |
| 家族 Family family | b.35.1.1 — GroES |
| 结构域编号 domain_id | d1hx5e_ |
| 类 Class class | b — All beta proteins |
| 折叠类型 Fold fold | b.35 — GroES-like |
| 超家族 Superfamily superfamily | b.35.1 — GroES-like |
| 家族 Family family | b.35.1.1 — GroES |
| 结构域编号 domain_id | d1hx5f_ |
| 类 Class class | b — All beta proteins |
| 折叠类型 Fold fold | b.35 — GroES-like |
| 超家族 Superfamily superfamily | b.35.1 — GroES-like |
| 家族 Family family | b.35.1.1 — GroES |
| 结构域编号 domain_id | d1hx5g_ |
| 类 Class class | b — All beta proteins |
| 折叠类型 Fold fold | b.35 — GroES-like |
| 超家族 Superfamily superfamily | b.35.1 — GroES-like |
| 家族 Family family | b.35.1.1 — GroES |
CATH v4.4 (7 domains)
| 结构域编号 domain_id | 1hx5A00 |
| 类 Class class | 2 — Mainly Beta |
| 架构 Architecture architecture | 30 — Roll |
| 拓扑 Topology topology | 33 — 10 Kd Chaperonin, Protein Cpn10; Chain O |
| 同源超家族 H-superfamily homologous superfamily | 40 — GroES chaperonin |
| 结构域编号 domain_id | 1hx5B00 |
| 类 Class class | 2 — Mainly Beta |
| 架构 Architecture architecture | 30 — Roll |
| 拓扑 Topology topology | 33 — 10 Kd Chaperonin, Protein Cpn10; Chain O |
| 同源超家族 H-superfamily homologous superfamily | 40 — GroES chaperonin |
| 结构域编号 domain_id | 1hx5C00 |
| 类 Class class | 2 — Mainly Beta |
| 架构 Architecture architecture | 30 — Roll |
| 拓扑 Topology topology | 33 — 10 Kd Chaperonin, Protein Cpn10; Chain O |
| 同源超家族 H-superfamily homologous superfamily | 40 — GroES chaperonin |
| 结构域编号 domain_id | 1hx5D00 |
| 类 Class class | 2 — Mainly Beta |
| 架构 Architecture architecture | 30 — Roll |
| 拓扑 Topology topology | 33 — 10 Kd Chaperonin, Protein Cpn10; Chain O |
| 同源超家族 H-superfamily homologous superfamily | 40 — GroES chaperonin |
| 结构域编号 domain_id | 1hx5E00 |
| 类 Class class | 2 — Mainly Beta |
| 架构 Architecture architecture | 30 — Roll |
| 拓扑 Topology topology | 33 — 10 Kd Chaperonin, Protein Cpn10; Chain O |
| 同源超家族 H-superfamily homologous superfamily | 40 — GroES chaperonin |
| 结构域编号 domain_id | 1hx5F00 |
| 类 Class class | 2 — Mainly Beta |
| 架构 Architecture architecture | 30 — Roll |
| 拓扑 Topology topology | 33 — 10 Kd Chaperonin, Protein Cpn10; Chain O |
| 同源超家族 H-superfamily homologous superfamily | 40 — GroES chaperonin |
| 结构域编号 domain_id | 1hx5G00 |
| 类 Class class | 2 — Mainly Beta |
| 架构 Architecture architecture | 30 — Roll |
| 拓扑 Topology topology | 33 — 10 Kd Chaperonin, Protein Cpn10; Chain O |
| 同源超家族 H-superfamily homologous superfamily | 40 — GroES chaperonin |