4CND
Crystal structure of E.coli TrmJ
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-08-01 |
| Detector | ADSC QUANTUM 210 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.400, 73.030, 53.330 |
| Unit cell angles | 90.00, 105.13, 90.00 |
Refinement procedure
| Resolution | 40.930 - 1.500 |
| R-factor | 0.19696 |
| Rwork | 0.195 |
| R-free | 0.22822 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ilk |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.712 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.600 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.060 | 0.880 |
| Number of reflections | 49018 | |
| <I/σ(I)> | 23.2 | 2 |
| Completeness [%] | 97.5 | 80.3 |
| Redundancy | 7.2 | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 0.02M NA/KPO4, 0.1M MES PH6.5, 19% PEG3350 |
