5G1T
S. enterica HisA mutant dup13-15, D10G
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Collection date | 2012-10-05 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 87.220, 87.220, 121.860 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.549 - 1.700 |
R-factor | 0.1729 |
Rwork | 0.172 |
R-free | 0.19960 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4gj1 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.057 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.800 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.050 | 0.460 |
Number of reflections | 30762 | |
<I/σ(I)> | 30.7 | 5.4 |
Completeness [%] | 99.9 | 100 |
Redundancy | 10.7 | 11 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.1M HEPES, PH 7.5, 0.8M NAH2PO4 AND 0.8M KH2PO4 |