1d97
CHIRAL PHOSPHOROTHIOATE ANALOGUES OF B-DNA: THE CRYSTAL STRUCTURE OF RP-D(GP(S) CPGP(S)CPGP(S)C)
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1d97 |
| deposition_date | 1992-10-17 |
| title | CHIRAL PHOSPHOROTHIOATE ANALOGUES OF B-DNA: THE CRYSTAL STRUCTURE OF RP-D(GP(S) CPGP(S)CPGP(S)C) |
| keywords | B-DNA, DOUBLE HELIX, MODIFIED, DNA; DNA |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 9.66 Å |
| rg_electron | 8.74 Å |
| i0 | 816227.00 |
| molecular_weight | 3691.0 kDa |
| excluded_volume | 3531 ų |
| envelope_volume | 4354 ų |
| shell_volume | 4773 ų |
| envelope_diameter | 29.0 Å |
| shell_rg | 13.06 Å |
| envelope_rg | 8.92 Å |
| shape_rg | 8.49 Å |
| total_rg | 9.97 Å |
| total_atoms | 240 |
| n_residues | 6 |
| 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 | 31.4 Å |
| rg_real | 9.61 Å |
| rg_real_error | 0.22 Å |
| i0_real | 8.1620e+05 |
| i0_real_error | 7.7920e+03 |
| rg_reciprocal | 9.61 Å |
| i0_reciprocal | 816200.0000 |
| total_estimate | 0.8892 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 12.7 Å |
| skewness | 0.109 |
| kurtosis | -0.315 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 40560.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.859; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 1.000; Smooth: 0.978 |