6FTD
Deinococcus radiodurans BphP PAS-GAF H290T mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-3 |
Synchrotron site | ESRF |
Beamline | MASSIF-3 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-06-23 |
Detector | DECTRIS EIGER X 4M |
Wavelength(s) | 0.96770 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 94.810, 53.030, 135.880 |
Unit cell angles | 90.00, 93.30, 90.00 |
Refinement procedure
Resolution | 47.330 - 1.400 |
R-factor | 0.15046 |
Rwork | 0.148 |
R-free | 0.19816 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5k5b |
RMSD bond length | 0.028 |
RMSD bond angle | 2.551 |
Data reduction software | XDS (March 1, 2015) |
Data scaling software | XSCALE |
Phasing software | PHASER (2.5.7) |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.330 | 1.440 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.108 | 1.362 |
Rmeas | 0.124 | 1.552 |
Number of reflections | 132351 | 9607 |
<I/σ(I)> | 7.48 | 0.93 |
Completeness [%] | 99.7 | 99.5 |
Redundancy | 4.25 | 4.26 |
CC(1/2) | 0.997 | 0.336 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.95 | 297 | 67 mM Sodium acetate, 3.3 % PEG400, 1mM DTT, 30% 2-methyl-2,4-pentanediol |