5VAS
Pekin duck egg lysozyme isoform III (DEL-III), orthorhombic form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-03-11 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 44.005, 58.350, 107.480 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 27.780 - 1.400 |
| R-factor | 0.1451 |
| Rwork | 0.144 |
| R-free | 0.16930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1iee |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.400 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 27.780 | 27.780 | 1.420 |
| High resolution limit [Å] | 1.400 | 7.670 | 1.400 |
| Rmerge | 0.091 | 0.034 | 0.912 |
| Rmeas | 0.094 | 0.035 | 0.946 |
| Rpim | 0.024 | 0.010 | 0.249 |
| Total number of observations | 803682 | ||
| Number of reflections | 55408 | ||
| <I/σ(I)> | 17.8 | ||
| Completeness [%] | 100.0 | 97.6 | 100 |
| Redundancy | 14.5 | 12.1 | 14.1 |
| CC(1/2) | 0.999 | 0.999 | 0.848 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 2.4 M ammonium phosphate monobasic, 100 mM Tris, pH 8.5 |
