9s5b
Fragment screening of FosAKP, room-temperature structure, ground state, small unit cell
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 9s5b |
| deposition_date | 2025-07-29 |
| last_revision | 2025-10-22 |
| title | Fragment screening of FosAKP, room-temperature structure, ground state, small unit cell |
| keywords | antibiotic resistance, fosfomycin, fragment screening, TRANSFERASE; TRANSFERASE |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 19.31 Å |
| rg_electron | 18.18 Å |
| i0 | 16695200.00 |
| molecular_weight | 30739.0 kDa |
| excluded_volume | 38326 ų |
| envelope_volume | 44106 ų |
| shell_volume | 19934 ų |
| envelope_diameter | 63.8 Å |
| shell_rg | 24.78 Å |
| envelope_rg | 18.41 Å |
| shape_rg | 18.17 Å |
| total_rg | 19.14 Å |
| total_atoms | 4243 |
| n_residues | 276 |
| 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 | 62.0 Å |
| rg_real | 19.16 Å |
| rg_real_error | 0.29 Å |
| i0_real | 1.6700e+07 |
| i0_real_error | 1.9490e+05 |
| rg_reciprocal | 19.19 Å |
| i0_reciprocal | 16700000.0000 |
| total_estimate | 0.8863 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 24.5 Å |
| skewness | 0.128 |
| kurtosis | -0.400 |
| angular_range | — – 0.4100 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 4444000.0000 |
| n_real_points | 72 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.842; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.996; Smooth: 0.995 |