1b0s
BINDING OF AR-1-144, A TRI-IMIDAZOLE DNA MINOR GROOVE BINDER, TO CCGG SEQUENCE ANALYZED BY NMR SPECTROSCOPY
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1b0s |
| deposition_date | 1998-11-12 |
| title | BINDING OF AR-1-144, A TRI-IMIDAZOLE DNA MINOR GROOVE BINDER, TO CCGG SEQUENCE ANALYZED BY NMR SPECTROSCOPY |
| keywords | ANTICANCER DRUG, DRUG DESIGN, DNA STRUCTURE, SEQUENCE SPECIFIC RECOGNITION, DNA; DNA |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 12.06 Å |
| rg_electron | 11.43 Å |
| i0 | 2450250.00 |
| molecular_weight | 7045.0 kDa |
| excluded_volume | 6972 ų |
| envelope_volume | 8359 ų |
| shell_volume | 6769 ų |
| envelope_diameter | 43.9 Å |
| shell_rg | 16.19 Å |
| envelope_rg | 12.03 Å |
| shape_rg | 11.28 Å |
| total_rg | 12.43 Å |
| total_atoms | 758 |
| n_residues | 20 |
| 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 | 46.9 Å |
| rg_real | 12.09 Å |
| rg_real_error | 0.42 Å |
| i0_real | 2.4500e+06 |
| i0_real_error | 2.9140e+04 |
| rg_reciprocal | 12.09 Å |
| i0_reciprocal | 2450000.0000 |
| total_estimate | 0.7173 |
| solution_quality | REASONABLE a REASONABLE solution |
| n_peaks | 3 |
| r_peak_primary | 13.1 Å |
| skewness | 0.414 |
| kurtosis | -0.242 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 180400.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.583; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.572; Smooth: 0.000 |