1aal
;STRUCTURAL EFFECTS INDUCED BY MUTAGENESIS AFFECTED BY CRYSTAL PACKING FACTORS: THE STRUCTURE OF A 30-51 DISULFIDE MUTANT OF BASIC PANCREATIC TRYPSIN INHIBITOR ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1aal |
| deposition_date | 1992-04-09 |
| title | ;STRUCTURAL EFFECTS INDUCED BY MUTAGENESIS AFFECTED BY CRYSTAL PACKING FACTORS: THE STRUCTURE OF A 30-51 DISULFIDE MUTANT OF BASIC PANCREATIC TRYPSIN INHIBITOR ; |
| keywords | SERINE PROTEASE INHIBITOR; SERINE PROTEASE INHIBITOR |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 17.29 Å |
| rg_electron | 16.62 Å |
| i0 | 3609630.00 |
| molecular_weight | 12982.0 kDa |
| excluded_volume | 16023 ų |
| envelope_volume | 19099 ų |
| shell_volume | 10644 ų |
| envelope_diameter | 60.3 Å |
| shell_rg | 20.82 Å |
| envelope_rg | 16.97 Å |
| shape_rg | 16.51 Å |
| total_rg | 17.70 Å |
| total_atoms | 907 |
| n_residues | 115 |
| 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 | 61.4 Å |
| rg_real | 17.43 Å |
| rg_real_error | 0.54 Å |
| i0_real | 3.6100e+06 |
| i0_real_error | 4.2570e+04 |
| rg_reciprocal | 17.41 Å |
| i0_reciprocal | 3610000.0000 |
| total_estimate | 0.8262 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 1 |
| r_peak_primary | 59.8 Å |
| skewness | 0.487 |
| kurtosis | -0.345 |
| angular_range | — – 0.4600 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 984700.0000 |
| n_real_points | 77 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.723; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.578; Smooth: 0.991 |