1c3t
ROTAMER STRAIN AS A DETERMINANT OF PROTEIN STRUCTURAL SPECIFICITY
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1c3t |
| deposition_date | 1999-07-28 |
| title | ROTAMER STRAIN AS A DETERMINANT OF PROTEIN STRUCTURAL SPECIFICITY |
| keywords | PROTEIN DESIGN, HYDROPHOBIC CORE, PACKING, ROTAMERS, ROC, UBIQUITIN, DE NOVO PROTEIN; DE NOVO PROTEIN |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 12.26 Å |
| rg_electron | 11.72 Å |
| i0 | 395686000.00 |
| molecular_weight | 171300.0 kDa |
| excluded_volume | 216330 ų |
| envelope_volume | 19233 ų |
| shell_volume | 11929 ų |
| envelope_diameter | 47.2 Å |
| shell_rg | 19.59 Å |
| envelope_rg | 14.39 Å |
| shape_rg | 11.70 Å |
| total_rg | 11.97 Å |
| total_atoms | 24640 |
| n_residues | 1520 |
| 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 | 43.1 Å |
| rg_real | 12.18 Å |
| rg_real_error | 0.40 Å |
| i0_real | 3.9570e+08 |
| i0_real_error | 4.8730e+06 |
| rg_reciprocal | 12.18 Å |
| i0_reciprocal | 395700000.0000 |
| total_estimate | 0.7982 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 16.4 Å |
| skewness | 0.129 |
| kurtosis | 0.103 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 201600.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.460; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.999; Smooth: 0.992 |