1c2l
RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1c2l |
| deposition_date | 1999-07-21 |
| title | RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES |
| keywords | ;ZN(II)-MEDIATED SERINE PROTEASE INHIBITORS, PH DEPENDENCE, ZN(II) AFFINITY STUCTURE-BASED DRUG DESIGN, SERINE PROTEASE, HYDROLASE-HYDROLASE INHIBITOR COMPLEX ;; HYDROLASE/HYDROLASE INHIBITOR |
| method | X-RAY DIFFRACTION |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 17.09 Å |
| rg_electron | 16.03 Å |
| i0 | 10839100.00 |
| molecular_weight | 23518.0 kDa |
| excluded_volume | 28982 ų |
| envelope_volume | 31755 ų |
| shell_volume | 16357 ų |
| envelope_diameter | 54.1 Å |
| shell_rg | 22.33 Å |
| envelope_rg | 16.27 Å |
| shape_rg | 16.04 Å |
| total_rg | 16.96 Å |
| total_atoms | 3223 |
| n_residues | 223 |
| 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 | 52.9 Å |
| rg_real | 16.97 Å |
| rg_real_error | 0.22 Å |
| i0_real | 1.0840e+07 |
| i0_real_error | 1.1230e+05 |
| rg_reciprocal | 16.99 Å |
| i0_reciprocal | 10840000.0000 |
| total_estimate | 0.8981 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 2 |
| r_peak_primary | 22.3 Å |
| skewness | 0.124 |
| kurtosis | -0.451 |
| angular_range | — – 0.4650 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 2815000.0000 |
| n_real_points | 77 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.901; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.989; Smooth: 0.981 |