3ZIJ
Crystal structure of the thioredoxin-like protein BC3987
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-04-04 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 24.700, 98.870, 25.070 |
| Unit cell angles | 90.00, 91.79, 90.00 |
Refinement procedure
| Resolution | 32.980 - 1.400 |
| R-factor | 0.18881 |
| Rwork | 0.188 |
| R-free | 0.20537 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1r7h |
| RMSD bond length | 0.026 |
| RMSD bond angle | 2.435 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.000 | 1.480 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.030 | 0.110 |
| Number of reflections | 22238 | |
| <I/σ(I)> | 15 | 6.1 |
| Completeness [%] | 94.3 | 93.8 |
| Redundancy | 2.6 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 0.1 M HEPES PH 7.5, 50 MM MGCL2, AND 30 % (W/V) POLYETHYLENE GLYCOL MONOMETHYL ETHER 550 |
