1ayu
CRYSTAL STRUCTURE OF CYSTEINE PROTEASE HUMAN CATHEPSIN K IN COMPLEX WITH A COVALENT SYMMETRIC BISCARBOHYDRAZIDE INHIBITOR
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1ayu |
| deposition_date | 1997-11-10 |
| title | CRYSTAL STRUCTURE OF CYSTEINE PROTEASE HUMAN CATHEPSIN K IN COMPLEX WITH A COVALENT SYMMETRIC BISCARBOHYDRAZIDE INHIBITOR |
| keywords | HYDROLASE, SULFHYDRYL PROTEINASE; HYDROLASE |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 17.50 Å |
| rg_electron | 16.31 Å |
| i0 | 11249700.00 |
| molecular_weight | 24087.0 kDa |
| excluded_volume | 29807 ų |
| envelope_volume | 33252 ų |
| shell_volume | 16812 ų |
| envelope_diameter | 57.6 Å |
| shell_rg | 22.75 Å |
| envelope_rg | 16.67 Å |
| shape_rg | 16.27 Å |
| total_rg | 17.44 Å |
| total_atoms | 1691 |
| n_residues | 215 |
| 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 | 55.6 Å |
| rg_real | 17.39 Å |
| rg_real_error | 0.32 Å |
| i0_real | 1.1250e+07 |
| i0_real_error | 1.3790e+05 |
| rg_reciprocal | 17.41 Å |
| i0_reciprocal | 11250000.0000 |
| total_estimate | 0.8129 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 3 |
| r_peak_primary | 22.2 Å |
| skewness | 0.189 |
| kurtosis | -0.345 |
| angular_range | — – 0.4550 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 2746000.0000 |
| n_real_points | 76 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.856; Stabil: 0.999; Sysdev: 1.000; Positv: 1.000; Valcen: 0.998; Smooth: 0.000 |