1a2n
STRUCTURE OF THE C115A MUTANT OF MURA COMPLEXED WITH THE FLUORINATED ANALOG OF THE REACTION TETRAHEDRAL INTERMEDIATE
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1a2n |
| deposition_date | 1998-01-06 |
| title | STRUCTURE OF THE C115A MUTANT OF MURA COMPLEXED WITH THE FLUORINATED ANALOG OF THE REACTION TETRAHEDRAL INTERMEDIATE |
| keywords | TRANSFERASE, PEPTIDOGLYCAN SYNTHESIS, ENOLPYRUVYL TRANSFERASE, UDP-N-ACETYLGLUCOSAMINE; TRANSFERASE |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 22.30 Å |
| rg_electron | 21.31 Å |
| i0 | 35262800.00 |
| molecular_weight | 45369.0 kDa |
| excluded_volume | 56705 ų |
| envelope_volume | 63342 ų |
| shell_volume | 24575 ų |
| envelope_diameter | 72.0 Å |
| shell_rg | 28.10 Å |
| envelope_rg | 21.44 Å |
| shape_rg | 21.33 Å |
| total_rg | 22.05 Å |
| total_atoms | 3178 |
| n_residues | 418 |
| 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 | 70.9 Å |
| rg_real | 22.24 Å |
| rg_real_error | 0.37 Å |
| i0_real | 3.5260e+07 |
| i0_real_error | 4.4210e+05 |
| rg_reciprocal | 22.25 Å |
| i0_reciprocal | 35260000.0000 |
| total_estimate | 0.8925 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 26.9 Å |
| skewness | 0.303 |
| kurtosis | -0.380 |
| angular_range | — – 0.3550 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 16290000.0000 |
| n_real_points | 67 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.869; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.999; Smooth: 0.992 |