1d18
;SOLUTION CONFORMATION OF PURINE-PYRIMIDINE DNA OCTAMERS USING NUCLEAR MAGNETIC RESONANCE, RESTRAINED MOLECULAR DYNAMICS AND NOE-BASED REFINEMENT ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1d18 |
| deposition_date | 1990-08-01 |
| title | ;SOLUTION CONFORMATION OF PURINE-PYRIMIDINE DNA OCTAMERS USING NUCLEAR MAGNETIC RESONANCE, RESTRAINED MOLECULAR DYNAMICS AND NOE-BASED REFINEMENT ; |
| keywords | DNA, DOUBLE HELIX; DNA |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 10.90 Å |
| rg_electron | 10.03 Å |
| i0 | 1291100.00 |
| molecular_weight | 4831.0 kDa |
| excluded_volume | 4720 ų |
| envelope_volume | 6073 ų |
| shell_volume | 5685 ų |
| envelope_diameter | 32.2 Å |
| shell_rg | 14.42 Å |
| envelope_rg | 10.30 Å |
| shape_rg | 9.87 Å |
| total_rg | 11.14 Å |
| total_atoms | 506 |
| n_residues | 16 |
| 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 | 35.2 Å |
| rg_real | 10.86 Å |
| rg_real_error | 0.25 Å |
| i0_real | 1.2910e+06 |
| i0_real_error | 1.3520e+04 |
| rg_reciprocal | 10.86 Å |
| i0_reciprocal | 1291000.0000 |
| total_estimate | 0.8975 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 1 |
| r_peak_primary | 34.3 Å |
| skewness | 0.216 |
| kurtosis | -0.328 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 72910.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.902; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.999; Smooth: 0.958 |