7OL5
Crystal structure of Lysozyme in complex with Hepes
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-09-30 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 77.198, 77.198, 37.958 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 18.720 - 0.940 |
| R-factor | 0.1542 |
| Rwork | 0.154 |
| R-free | 0.16320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6f1o |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.009 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.4) |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.1_4122) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 18.720 | 18.720 | 0.950 |
| High resolution limit [Å] | 0.940 | 5.130 | 0.940 |
| Rmerge | 0.067 | 0.095 | 0.705 |
| Rmeas | 0.069 | 0.098 | 0.768 |
| Rpim | 0.015 | 0.022 | 0.296 |
| Total number of observations | 10549 | 19635 | |
| Number of reflections | 73762 | 548 | 3051 |
| <I/σ(I)> | 35.8 | 62.2 | 2.8 |
| Completeness [%] | 97.5 | 98.3 | 83.9 |
| Redundancy | 17.3 | 19.2 | 6.4 |
| CC(1/2) | 0.998 | 0.995 | 0.889 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 0.1M Hepes, 10% isopropanol, 20% PEG 4000 |
