1au0
;CRYSTAL STRUCTURE OF THE CYSTEINE PROTEASE HUMAN CATHEPSIN K IN COMPLEX WITH A COVALENT SYMMETRIC DIACYLAMINOMETHYL KETONE INHIBITOR ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1au0 |
| deposition_date | 1997-09-09 |
| title | ;CRYSTAL STRUCTURE OF THE CYSTEINE PROTEASE HUMAN CATHEPSIN K IN COMPLEX WITH A COVALENT SYMMETRIC DIACYLAMINOMETHYL KETONE INHIBITOR ; |
| keywords | HYDROLASE, SULFHYDRYL PROTEINASE; HYDROLASE |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 17.53 Å |
| rg_electron | 16.34 Å |
| i0 | 11088700.00 |
| molecular_weight | 24085.0 kDa |
| excluded_volume | 29845 ų |
| envelope_volume | 33331 ų |
| shell_volume | 16845 ų |
| envelope_diameter | 56.1 Å |
| shell_rg | 22.78 Å |
| envelope_rg | 16.68 Å |
| shape_rg | 16.31 Å |
| total_rg | 17.45 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 | 56.5 Å |
| rg_real | 17.42 Å |
| rg_real_error | 0.21 Å |
| i0_real | 1.1090e+07 |
| i0_real_error | 1.0580e+05 |
| rg_reciprocal | 17.44 Å |
| i0_reciprocal | 11090000.0000 |
| total_estimate | 0.8895 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 21.9 Å |
| skewness | 0.178 |
| kurtosis | -0.381 |
| angular_range | — – 0.4550 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 2814000.0000 |
| n_real_points | 76 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.854; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.999; Smooth: 0.999 |