1ac9
;SOLUTION STRUCTURE OF A DNA DECAMER CONTAINING THE ANTIVIRAL DRUG GANCICLOVIR: COMBINED USE OF NMR, RESTRAINED MOLECULAR DYNAMICS, AND FULL RELAXATION REFINEMENT, 6 STRUCTURES ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1ac9 |
| deposition_date | 1997-02-17 |
| title | ;SOLUTION STRUCTURE OF A DNA DECAMER CONTAINING THE ANTIVIRAL DRUG GANCICLOVIR: COMBINED USE OF NMR, RESTRAINED MOLECULAR DYNAMICS, AND FULL RELAXATION REFINEMENT, 6 STRUCTURES ; |
| keywords | DNA DECAMER, DEOXYRIBONUCLEIC ACID, DNA; DNA |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 11.57 Å |
| rg_electron | 11.52 Å |
| i0 | 53892800.00 |
| molecular_weight | 36289.0 kDa |
| excluded_volume | 35167 ų |
| envelope_volume | 8647 ų |
| shell_volume | 6824 ų |
| envelope_diameter | 42.6 Å |
| shell_rg | 16.28 Å |
| envelope_rg | 12.15 Å |
| shape_rg | 11.38 Å |
| total_rg | 11.92 Å |
| total_atoms | 3780 |
| n_residues | 108 |
| 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 | 39.7 Å |
| rg_real | 11.58 Å |
| rg_real_error | 0.34 Å |
| i0_real | 5.3890e+07 |
| i0_real_error | 5.9240e+05 |
| rg_reciprocal | 11.58 Å |
| i0_reciprocal | 53890000.0000 |
| total_estimate | 0.8749 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 3 |
| r_peak_primary | 13.6 Å |
| skewness | 0.299 |
| kurtosis | -0.363 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 49620.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.824; Stabil: 0.997; Sysdev: 1.000; Positv: 1.000; Valcen: 0.936; Smooth: 0.968 |