4AYG
Lactobacillus reuteri N-terminally truncated glucansucrase GTF180 in orthorhombic apo-form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X12 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X12 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-09-28 |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 92.792, 147.363, 244.374 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.000 |
| R-factor | 0.15625 |
| Rwork | 0.155 |
| R-free | 0.18306 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3klk |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.270 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.090 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.340 |
| Number of reflections | 201509 | |
| <I/σ(I)> | 16.7 | 3.1 |
| Completeness [%] | 93.8 | 69.5 |
| Redundancy | 6.3 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 2.2 M (NH4)2SO4, 5% (V/V) 2-PROPANOL, 25 MM HAC/NAAC PH 5.0, 50 MM NACL, 1 MM CACL2 |
