1bzy
HUMAN HGPRTASE WITH TRANSITION STATE INHIBITOR
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1bzy |
| deposition_date | 1998-11-05 |
| title | HUMAN HGPRTASE WITH TRANSITION STATE INHIBITOR |
| keywords | ;PHOSPHORIBOSYLTRANSFERASE, IMMUCILLIN, LESCH-NYHAN, HGPRT, TRANSITION STATE, MAGNESIUM, PYROPHOSPHATE, OXOCARBENIUM ION, NEIGHBORING GROUP PARTICIPATION ;; PHOSPHORIBOSYLTRANSFERASE |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 28.01 Å |
| rg_electron | 26.73 Å |
| i0 | 155908000.00 |
| molecular_weight | 98811.0 kDa |
| excluded_volume | 123650 ų |
| envelope_volume | 141760 ų |
| shell_volume | 41973 ų |
| envelope_diameter | 85.0 Å |
| shell_rg | 36.08 Å |
| envelope_rg | 26.74 Å |
| shape_rg | 26.71 Å |
| total_rg | 27.67 Å |
| total_atoms | 6920 |
| n_residues | 856 |
| 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 | 84.7 Å |
| rg_real | 27.81 Å |
| rg_real_error | 0.46 Å |
| i0_real | 1.5590e+08 |
| i0_real_error | 2.0660e+06 |
| rg_reciprocal | 27.87 Å |
| i0_reciprocal | 155900000.0000 |
| total_estimate | 0.9019 |
| solution_quality | EXCELLENT a EXCELLENT solution |
| n_peaks | 2 |
| r_peak_primary | 35.7 Å |
| skewness | 0.152 |
| kurtosis | -0.465 |
| angular_range | — – 0.2850 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 52700000.0000 |
| n_real_points | 58 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.931; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.979; Smooth: 0.948 |