1aqr
CU-METALLOTHIONEIN FROM SACCHAROMYCES CEREVISIAE, NMR, MINIMIZED AVERAGE STRUCTURE
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1aqr |
| deposition_date | 1997-07-31 |
| title | CU-METALLOTHIONEIN FROM SACCHAROMYCES CEREVISIAE, NMR, MINIMIZED AVERAGE STRUCTURE |
| keywords | METALLOTHIONEIN, COPPER DETOXIFICATION, METAL-THIOLATE CLUSTER; METALLOTHIONEIN |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 9.81 Å |
| rg_electron | 9.13 Å |
| i0 | 997850.00 |
| molecular_weight | 4714.0 kDa |
| excluded_volume | 4991 ų |
| envelope_volume | 6246 ų |
| shell_volume | 5994 ų |
| envelope_diameter | 32.8 Å |
| shell_rg | 14.28 Å |
| envelope_rg | 9.99 Å |
| shape_rg | 9.49 Å |
| total_rg | 9.85 Å |
| total_atoms | 531 |
| n_residues | 40 |
| n_harmonics | 20 |
| q_range | — – 0.5000 Å−1 |
| n_points | 101 |
| shell_type | directional |
| solvent_density | 0.3340 e/ų |
| contrast_shell | 0.0300 e/ų |
| crysol_version | 4.1.3 |
3. P(r) Analysis (GNOM)
| dmax | 34.8 Å |
| rg_real | 9.85 Å |
| rg_real_error | 0.29 Å |
| i0_real | 9.9790e+05 |
| i0_real_error | 1.0620e+04 |
| rg_reciprocal | 9.85 Å |
| i0_reciprocal | 997800.0000 |
| total_estimate | 0.7035 |
| solution_quality | REASONABLE a REASONABLE solution |
| n_peaks | 2 |
| r_peak_primary | 11.0 Å |
| skewness | 0.460 |
| kurtosis | -0.036 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 45730.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.754; Stabil: 1.000; Sysdev: 0.368; Positv: 1.000; Valcen: 0.863; Smooth: 0.914 |