1da1
STRUCTURAL CHARACTERISATION OF THE BROMOURACIL-GUANINE BASE PAIR MISMATCH IN A Z-DNA FRAGMENT
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1da1 |
| deposition_date | 1992-10-17 |
| title | STRUCTURAL CHARACTERISATION OF THE BROMOURACIL-GUANINE BASE PAIR MISMATCH IN A Z-DNA FRAGMENT |
| keywords | Z-DNA, DOUBLE HELIX, MODIFIED, MISMATCHED, DNA; DNA |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 10.13 Å |
| rg_electron | 9.35 Å |
| i0 | 877102.00 |
| molecular_weight | 3779.0 kDa |
| excluded_volume | 3535 ų |
| envelope_volume | 4762 ų |
| shell_volume | 4969 ų |
| envelope_diameter | 31.1 Å |
| shell_rg | 13.48 Å |
| envelope_rg | 9.43 Å |
| shape_rg | 9.23 Å |
| total_rg | 10.36 Å |
| total_atoms | 243 |
| n_residues | 10 |
| 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 | 32.9 Å |
| rg_real | 10.11 Å |
| rg_real_error | 0.24 Å |
| i0_real | 8.7710e+05 |
| i0_real_error | 8.1400e+03 |
| rg_reciprocal | 10.11 Å |
| i0_reciprocal | 877100.0000 |
| total_estimate | 0.8952 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 12.1 Å |
| skewness | 0.259 |
| kurtosis | -0.303 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 59830.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.895; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.995; Smooth: 0.954 |