4LJ7
ClpB NBD2 K601Q from T. thermophilus in complex with MANT-dADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2010-05-02 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.9787 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 65.690, 103.880, 159.110 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.380 - 2.800 |
| R-factor | 0.24315 |
| Rwork | 0.240 |
| R-free | 0.29484 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4lj5 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.974 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.900 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.084 | 0.557 |
| Number of reflections | 27597 | |
| <I/σ(I)> | 11.2 | 2.2 |
| Completeness [%] | 93.1 | 78.3 |
| Redundancy | 3.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.1M HEPES/NaOH, 12% PEG 6000, 50mM magnesium chloride, 2mM MANT-dADP, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
