1cal
STRUCTURAL ANALYSIS OF THE ZINC HYDROXIDE-THR 199-GLU 106 HYDROGEN BONDING NETWORK IN HUMAN CARBONIC ANHYDRASE II
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1cal |
| deposition_date | 1992-09-17 |
| title | STRUCTURAL ANALYSIS OF THE ZINC HYDROXIDE-THR 199-GLU 106 HYDROGEN BONDING NETWORK IN HUMAN CARBONIC ANHYDRASE II |
| keywords | LYASE(OXO-ACID); LYASE(OXO-ACID) |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 18.75 Å |
| rg_electron | 17.46 Å |
| i0 | 14550100.00 |
| molecular_weight | 29062.0 kDa |
| excluded_volume | 36500 ų |
| envelope_volume | 41102 ų |
| shell_volume | 19166 ų |
| envelope_diameter | 60.7 Å |
| shell_rg | 24.15 Å |
| envelope_rg | 17.76 Å |
| shape_rg | 17.43 Å |
| total_rg | 18.54 Å |
| total_atoms | 2058 |
| n_residues | 258 |
| 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 | 59.3 Å |
| rg_real | 18.60 Å |
| rg_real_error | 0.29 Å |
| i0_real | 1.4550e+07 |
| i0_real_error | 1.6670e+05 |
| rg_reciprocal | 18.62 Å |
| i0_reciprocal | 14550000.0000 |
| total_estimate | 0.8904 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 24.4 Å |
| skewness | 0.053 |
| kurtosis | -0.465 |
| angular_range | — – 0.4250 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 2436000.0000 |
| n_real_points | 74 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.864; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.983; Smooth: 0.996 |