7RAX
ATP-binding state of the nucleotide-binding domain of Hsp70 DnaK mutant T199A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-14 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 60.806, 48.118, 63.951 |
| Unit cell angles | 90.00, 90.30, 90.00 |
Refinement procedure
| Resolution | 44.180 - 1.410 |
| R-factor | 0.1642 |
| Rwork | 0.164 |
| R-free | 0.18840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4jne |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.023 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.32) |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 48.120 | 48.120 | 1.380 |
| High resolution limit [Å] | 1.360 | 7.450 | 1.360 |
| Rmerge | 0.126 | 0.034 | 2.997 |
| Rmeas | 0.137 | 0.036 | 3.295 |
| Rpim | 0.052 | 0.014 | 1.338 |
| Total number of observations | 523261 | 3719 | 22066 |
| Number of reflections | 79232 | 536 | 3864 |
| <I/σ(I)> | 8.1 | 39.7 | 0.5 |
| Completeness [%] | 99.7 | 99.7 | 98.7 |
| Redundancy | 6.6 | 6.9 | 5.7 |
| CC(1/2) | 0.998 | 0.998 | 0.265 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 277.15 | 0.1 M HEPES pH 7.5, 0.2 M sodium iodide, 20% w/v PEG 3350 |
