1yov
Insights into the Ubiquitin Transfer Cascade from the refined structure of the activating enzyme for NEDD8
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 | 1yov |
| 沉积日期 deposition_date | 2005-01-28 |
| 结构标题 title | Insights into the Ubiquitin Transfer Cascade from the refined structure of the activating enzyme for NEDD8 |
| 关键词 keywords | ubiquitin, NEDD8, E1, APPBP1, UBA3, SIGNALING PROTEIN; SIGNALING PROTEIN |
| 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 | 44.22 Å |
| 回转半径 Rg (电子) rg_electron | 43.94 Å |
| 零角强度 I(0) i0 | 618495000.00 |
| 分子量 molecular_weight | 205320.0 kDa |
| 排除体积 excluded_volume | 257300 ų |
| 包络体积 envelope_volume | 356470 ų |
| 水化壳体积 shell_volume | 67865 ų |
| 包络直径 envelope_diameter | 150.3 Å |
| 壳层 Rg shell_rg | 47.70 Å |
| 包络 Rg envelope_rg | 43.59 Å |
| 形状 Rg shape_rg | 43.94 Å |
| 总 Rg total_rg | 44.11 Å |
| 总原子数 total_atoms | 14454 |
| 残基数 n_residues | 1834 |
| 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 | 151.8 Å |
| Rg (实空间) rg_real | 44.31 Å |
| Rg 误差 (实空间) rg_real_error | 1.32 Å |
| I(0) (实空间) i0_real | 6.1850e+08 |
| I(0) 误差 (实空间) i0_real_error | 1.0610e+07 |
| Rg (倒空间) rg_reciprocal | 44.22 Å |
| I(0) (倒空间) i0_reciprocal | 618400000.0000 |
| 解质量估计 total_estimate | 0.8714 |
| 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 | 46.4 Å |
| 偏度 Skewness skewness | 0.400 |
| 峰度 Kurtosis kurtosis | -0.370 |
| 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 | 87970000.0000 |
| 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: 0.828; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.978; Smooth: 0.862 |
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) 12 domains
SCOP 2.08 (4 domains)
| 结构域编号 domain_id | d1yova_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.111 — Activating enzymes of the ubiquitin-like proteins |
| 超家族 Superfamily superfamily | c.111.1 — Activating enzymes of the ubiquitin-like proteins |
| 家族 Family family | c.111.1.2 — Ubiquitin activating enzymes (UBA) |
| 结构域编号 domain_id | d1yovb_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.111 — Activating enzymes of the ubiquitin-like proteins |
| 超家族 Superfamily superfamily | c.111.1 — Activating enzymes of the ubiquitin-like proteins |
| 家族 Family family | c.111.1.2 — Ubiquitin activating enzymes (UBA) |
| 结构域编号 domain_id | d1yovc_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.111 — Activating enzymes of the ubiquitin-like proteins |
| 超家族 Superfamily superfamily | c.111.1 — Activating enzymes of the ubiquitin-like proteins |
| 家族 Family family | c.111.1.2 — Ubiquitin activating enzymes (UBA) |
| 结构域编号 domain_id | d1yovd_ |
| 类 Class class | c — Alpha and beta proteins (a/b) |
| 折叠类型 Fold fold | c.111 — Activating enzymes of the ubiquitin-like proteins |
| 超家族 Superfamily superfamily | c.111.1 — Activating enzymes of the ubiquitin-like proteins |
| 家族 Family family | c.111.1.2 — Ubiquitin activating enzymes (UBA) |
CATH v4.4 (8 domains)
| 结构域编号 domain_id | 1yovA01 |
| 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 | 720 — NAD(P)-binding Rossmann-like Domain |
| 结构域编号 domain_id | 1yovB01 |
| 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 | 720 — NAD(P)-binding Rossmann-like Domain |
| 结构域编号 domain_id | 1yovB02 |
| 类 Class class | 1 — Mainly Alpha |
| 架构 Architecture architecture | 10 — Orthogonal Bundle |
| 拓扑 Topology topology | 10 — Arc Repressor Mutant, subunit A |
| 同源超家族 H-superfamily homologous superfamily | 520 — Ubiquitin activating enzymes (Uba3). Chain: B, domain 2 |
| 结构域编号 domain_id | 1yovB03 |
| 类 Class class | 3 — Alpha Beta |
| 架构 Architecture architecture | 10 — Roll |
| 拓扑 Topology topology | 20 — Ubiquitin-like (UB roll) |
| 同源超家族 H-superfamily homologous superfamily | 260 — NEDD8-activating enzyme E1, catalytic subunit |
| 结构域编号 domain_id | 1yovC01 |
| 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 | 720 — NAD(P)-binding Rossmann-like Domain |
| 结构域编号 domain_id | 1yovD01 |
| 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 | 720 — NAD(P)-binding Rossmann-like Domain |
| 结构域编号 domain_id | 1yovD02 |
| 类 Class class | 1 — Mainly Alpha |
| 架构 Architecture architecture | 10 — Orthogonal Bundle |
| 拓扑 Topology topology | 10 — Arc Repressor Mutant, subunit A |
| 同源超家族 H-superfamily homologous superfamily | 520 — Ubiquitin activating enzymes (Uba3). Chain: B, domain 2 |
| 结构域编号 domain_id | 1yovD03 |
| 类 Class class | 3 — Alpha Beta |
| 架构 Architecture architecture | 10 — Roll |
| 拓扑 Topology topology | 20 — Ubiquitin-like (UB roll) |
| 同源超家族 H-superfamily homologous superfamily | 260 — NEDD8-activating enzyme E1, catalytic subunit |