1a6k
AQUOMET-MYOGLOBIN, ATOMIC RESOLUTION
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1a6k |
| deposition_date | 1998-02-26 |
| title | AQUOMET-MYOGLOBIN, ATOMIC RESOLUTION |
| keywords | HEME PROTEIN, MODEL COMPOUNDS, OXYGEN STORAGE, LIGAND BINDING GEOMETRY, CONFORMATIONAL SUBSTATES; HEME PROTEIN |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 16.47 Å |
| rg_electron | 15.07 Å |
| i0 | 5842750.00 |
| molecular_weight | 17921.0 kDa |
| excluded_volume | 22601 ų |
| envelope_volume | 24731 ų |
| shell_volume | 13900 ų |
| envelope_diameter | 49.5 Å |
| shell_rg | 20.84 Å |
| envelope_rg | 15.28 Å |
| shape_rg | 15.03 Å |
| total_rg | 16.24 Å |
| total_atoms | 1262 |
| n_residues | 151 |
| 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 | 49.8 Å |
| rg_real | 16.34 Å |
| rg_real_error | 0.23 Å |
| i0_real | 5.8430e+06 |
| i0_real_error | 6.1870e+04 |
| rg_reciprocal | 16.36 Å |
| i0_reciprocal | 5843000.0000 |
| total_estimate | 0.9051 |
| solution_quality | EXCELLENT a EXCELLENT solution |
| n_peaks | 2 |
| r_peak_primary | 21.1 Å |
| skewness | 0.087 |
| kurtosis | -0.472 |
| angular_range | — – 0.4850 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 791600.0000 |
| n_real_points | 79 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.936; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.983; Smooth: 0.971 |