1ate
;HIGH-RESOLUTION STRUCTURE OF ASCARIS TRYPSIN INHIBITOR IN SOLUTION: DIRECT EVIDENCE FOR A PH INDUCED CONFORMATIONAL TRANSITION IN THE REACTIVE SITE ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1ate |
| deposition_date | 1994-05-20 |
| title | ;HIGH-RESOLUTION STRUCTURE OF ASCARIS TRYPSIN INHIBITOR IN SOLUTION: DIRECT EVIDENCE FOR A PH INDUCED CONFORMATIONAL TRANSITION IN THE REACTIVE SITE ; |
| keywords | PROTEINASE INHIBITOR(TRYPSIN); PROTEINASE INHIBITOR(TRYPSIN) |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 11.63 Å |
| rg_electron | 12.02 Å |
| i0 | 808906000.00 |
| molecular_weight | 217560.0 kDa |
| excluded_volume | 262860 ų |
| envelope_volume | 18694 ų |
| shell_volume | 11324 ų |
| envelope_diameter | 50.2 Å |
| shell_rg | 19.66 Å |
| envelope_rg | 15.01 Å |
| shape_rg | 12.00 Å |
| total_rg | 12.17 Å |
| total_atoms | 29184 |
| n_residues | 1984 |
| 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 | 44.8 Å |
| rg_real | 11.64 Å |
| rg_real_error | 0.39 Å |
| i0_real | 8.0890e+08 |
| i0_real_error | 9.4420e+06 |
| rg_reciprocal | 11.64 Å |
| i0_reciprocal | 808900000.0000 |
| total_estimate | 0.8201 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 13.6 Å |
| skewness | 0.329 |
| kurtosis | -0.220 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0001 |
| highest_alpha | 71410.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.642; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.730; Smooth: 0.999 |