5G4E
S. enterica HisA mutant D10G, Dup13-15, Q24L, G102A, V106L
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2013-04-18 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.817, 88.830, 117.785 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.097 - 2.650 |
R-factor | 0.2434 |
Rwork | 0.240 |
R-free | 0.29910 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5g1t |
RMSD bond length | 0.004 |
RMSD bond angle | 0.757 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.500 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.170 | 0.990 |
Number of reflections | 19821 | |
<I/σ(I)> | 9.7 | 1.7 |
Completeness [%] | 95.2 | 80.5 |
Redundancy | 4.1 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.2 | 0.18 M AMMONIUM ACETATE, 0.09 M SODIUM ACETATE, PH 5.15, 27% W/V PEG4000 |