1ajx
HIV-1 PROTEASE IN COMPLEX WITH THE CYCLIC UREA INHIBITOR AHA001
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1ajx |
| deposition_date | 1997-05-11 |
| title | HIV-1 PROTEASE IN COMPLEX WITH THE CYCLIC UREA INHIBITOR AHA001 |
| keywords | PROTEASE, ASPARTYL PROTEASE, NON-PEPTIDE INHIBITOR, DRUG DESIGN, HIV-1; ASPARTYL PROTEASE |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 18.17 Å |
| rg_electron | 17.21 Å |
| i0 | 7833490.00 |
| molecular_weight | 22128.0 kDa |
| excluded_volume | 28440 ų |
| envelope_volume | 31320 ų |
| shell_volume | 15659 ų |
| envelope_diameter | 60.6 Å |
| shell_rg | 22.86 Å |
| envelope_rg | 17.47 Å |
| shape_rg | 17.20 Å |
| total_rg | 18.21 Å |
| total_atoms | 1556 |
| n_residues | 198 |
| 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 | 61.5 Å |
| rg_real | 18.14 Å |
| rg_real_error | 0.40 Å |
| i0_real | 7.8330e+06 |
| i0_real_error | 9.5750e+04 |
| rg_reciprocal | 18.15 Å |
| i0_reciprocal | 7834000.0000 |
| total_estimate | 0.7009 |
| solution_quality | REASONABLE a REASONABLE solution |
| n_peaks | 1 |
| r_peak_primary | 60.7 Å |
| skewness | 0.336 |
| kurtosis | -0.271 |
| angular_range | — – 0.4400 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 2885000.0000 |
| n_real_points | 75 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.771; Stabil: 1.000; Sysdev: 0.275; Positv: 1.000; Valcen: 0.995; Smooth: 0.975 |