1dwq
;Crystal Structure of Hydroxynitrile Lyase from Manihot esculenta in Complex with Substrates Acetone and Chloroacetone:Implications for the Mechanism of Cyanogenesis ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1dwq |
| deposition_date | 1999-12-10 |
| title | ;Crystal Structure of Hydroxynitrile Lyase from Manihot esculenta in Complex with Substrates Acetone and Chloroacetone:Implications for the Mechanism of Cyanogenesis ; |
| keywords | HYDROXYNITRILE LYASE, CHLOROACETONE COMPLEX; HYDROXYNITRILE LYASE |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 25.35 Å |
| rg_electron | 24.47 Å |
| i0 | 53503200.00 |
| molecular_weight | 59367.0 kDa |
| excluded_volume | 75232 ų |
| envelope_volume | 83441 ų |
| shell_volume | 28291 ų |
| envelope_diameter | 85.2 Å |
| shell_rg | 31.99 Å |
| envelope_rg | 24.63 Å |
| shape_rg | 24.49 Å |
| total_rg | 25.25 Å |
| total_atoms | 4191 |
| n_residues | 518 |
| 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 | 80.8 Å |
| rg_real | 25.33 Å |
| rg_real_error | 0.50 Å |
| i0_real | 5.3500e+07 |
| i0_real_error | 7.8850e+05 |
| rg_reciprocal | 25.34 Å |
| i0_reciprocal | 53500000.0000 |
| total_estimate | 0.8976 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 28.2 Å |
| skewness | 0.327 |
| kurtosis | -0.460 |
| angular_range | — – 0.3150 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 12880000.0000 |
| n_real_points | 64 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.894; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.992; Smooth: 0.991 |