9va3
Solution NMR structures of hTERT DNA G-quadruplexes (G4s) in complex with small molecule ZBH-01
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 9va3 |
| deposition_date | 2025-06-02 |
| title | Solution NMR structures of hTERT DNA G-quadruplexes (G4s) in complex with small molecule ZBH-01 |
| keywords | G-quadruplexes, Topoisomerase I, ZBH-01, DNA; DNA |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 10.98 Å |
| rg_electron | 10.77 Å |
| i0 | 868374000.00 |
| molecular_weight | 151080.0 kDa |
| excluded_volume | 146240 ų |
| envelope_volume | 11631 ų |
| shell_volume | 8727 ų |
| envelope_diameter | 39.8 Å |
| shell_rg | 17.00 Å |
| envelope_rg | 12.17 Å |
| shape_rg | 10.77 Å |
| total_rg | 10.84 Å |
| total_atoms | 15720 |
| n_residues | 440 |
| 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 | 37.6 Å |
| rg_real | 10.94 Å |
| rg_real_error | 0.28 Å |
| i0_real | 8.6840e+08 |
| i0_real_error | 8.3010e+06 |
| rg_reciprocal | 10.95 Å |
| i0_reciprocal | 868400000.0000 |
| total_estimate | 0.8725 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 12.9 Å |
| skewness | 0.272 |
| kurtosis | -0.274 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 205400.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.794; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.973; Smooth: 0.985 |