173d
;MULTIPLE BINDING MODES OF ANTICANCER DRUG ACTINOMYCIN D: X-RAY, MOLECULAR MODELING, AND SPECTROSCOPIC STUDIES OF D(GAAGCTTC)2-ACTINOMYCIN D COMPLEXES AND ITS HOST DNA ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 173d |
| deposition_date | 1994-04-18 |
| title | ;MULTIPLE BINDING MODES OF ANTICANCER DRUG ACTINOMYCIN D: X-RAY, MOLECULAR MODELING, AND SPECTROSCOPIC STUDIES OF D(GAAGCTTC)2-ACTINOMYCIN D COMPLEXES AND ITS HOST DNA ; |
| keywords | ACTINOMYCIN, ANTIBIOTIC, ANTITUMOR, ANTICANCER, CHROMOPHORE, DEPSIPEPTIDE, DNA-ANTIBIOTIC COMPLEX; DNA/ANTIBIOTIC |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 16.90 Å |
| rg_electron | 16.16 Å |
| i0 | 1573470.00 |
| molecular_weight | 6156.0 kDa |
| excluded_volume | 6432 ų |
| envelope_volume | 10102 ų |
| shell_volume | 5928 ų |
| envelope_diameter | 53.2 Å |
| shell_rg | 19.93 Å |
| envelope_rg | 15.53 Å |
| shape_rg | 16.07 Å |
| total_rg | 16.90 Å |
| total_atoms | 416 |
| 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 | 53.7 Å |
| rg_real | 16.92 Å |
| rg_real_error | 0.44 Å |
| i0_real | 1.5730e+06 |
| i0_real_error | 1.8980e+04 |
| rg_reciprocal | 16.92 Å |
| i0_reciprocal | 1573000.0000 |
| total_estimate | 0.6682 |
| solution_quality | REASONABLE a REASONABLE solution |
| n_peaks | 3 |
| r_peak_primary | 27.6 Å |
| skewness | 0.052 |
| kurtosis | -0.755 |
| angular_range | — – 0.4700 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 58960.0000 |
| n_real_points | 77 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.311; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.749; Smooth: 0.000 |