1diu
DIHYDROFOLATE REDUCTASE (E.C.1.5.1.3) COMPLEX WITH BRODIMOPRIM-4,6-DICARBOXYLATE
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1diu |
| deposition_date | 1995-08-01 |
| title | DIHYDROFOLATE REDUCTASE (E.C.1.5.1.3) COMPLEX WITH BRODIMOPRIM-4,6-DICARBOXYLATE |
| keywords | INHIBITOR-ENZYME COMPLEX, OXIDO-REDUCTASE, OXIDOREDUCTASE; OXIDOREDUCTASE |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 16.10 Å |
| rg_electron | 15.60 Å |
| i0 | 1575530000.00 |
| molecular_weight | 338380.0 kDa |
| excluded_volume | 422630 ų |
| envelope_volume | 27596 ų |
| shell_volume | 14873 ų |
| envelope_diameter | 54.7 Å |
| shell_rg | 21.63 Å |
| envelope_rg | 15.95 Å |
| shape_rg | 15.59 Å |
| total_rg | 15.69 Å |
| total_atoms | 47124 |
| n_residues | 2916 |
| 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 | 51.5 Å |
| rg_real | 16.00 Å |
| rg_real_error | 0.26 Å |
| i0_real | 1.5760e+09 |
| i0_real_error | 1.7490e+07 |
| rg_reciprocal | 16.01 Å |
| i0_reciprocal | 1576000000.0000 |
| total_estimate | 0.8868 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 21.5 Å |
| skewness | 0.127 |
| kurtosis | -0.392 |
| angular_range | — – 0.4950 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 792700.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.842; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.998; Smooth: 0.999 |