5KDK
Truncated hemolysin A from P. mirabilis at 2.0 Angstroms resolution crystallized in a high salt condition
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-03-05 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.978 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 34.440, 80.150, 96.610 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 61.685 - 2.002 |
| R-factor | 0.1608 |
| Rwork | 0.159 |
| R-free | 0.18870 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4w8q |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.889 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless (0.5.21) |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 61.690 | 61.690 | 2.050 |
| High resolution limit [Å] | 2.000 | 8.950 | 2.000 |
| Rmerge | 0.141 | 0.052 | 0.411 |
| Rmeas | 0.151 | ||
| Rpim | 0.053 | ||
| Total number of observations | 149045 | ||
| Number of reflections | 18777 | ||
| <I/σ(I)> | 12.5 | ||
| Completeness [%] | 100.0 | 99.9 | 100 |
| Redundancy | 7.9 | 6.2 | 7.7 |
| CC(1/2) | 0.995 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 298 | 1M LiSO4, 2% w/v PEG 8000 |
