6GDX
Structure of CutA from Synechococcus elongatus PCC7942 complexed with 3 molecules of Bis-Tris
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-12-12 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 35.602, 96.329, 48.912 |
| Unit cell angles | 90.00, 93.15, 90.00 |
Refinement procedure
| Resolution | 48.840 - 1.170 |
| R-factor | 0.15389 |
| Rwork | 0.153 |
| R-free | 0.17687 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6gdv |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.624 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.840 | 1.190 |
| High resolution limit [Å] | 1.170 | 1.170 |
| Rmerge | 0.034 | 0.031 |
| Rmeas | 0.039 | 0.036 |
| Rpim | 0.017 | 0.130 |
| Number of reflections | 110414 | 5494 |
| <I/σ(I)> | 21.6 | 5.3 |
| Completeness [%] | 99.9 | 99.6 |
| Redundancy | 4.6 | 3.9 |
| CC(1/2) | 0.999 | 0.998 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 294 | 0.1 M Bis-Tris pH 6.5, 23% PEG 3350 |
