4GEG
Crystal Structure of E.coli MenH Y85F Mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2011-11-22 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.953695 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 250.499, 41.589, 93.081 |
Unit cell angles | 90.00, 95.89, 90.00 |
Refinement procedure
Resolution | 33.710 - 2.490 |
R-factor | 0.1802 |
Rwork | 0.177 |
R-free | 0.24940 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.070 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.16) |
Phasing software | MOLREP |
Refinement software | BUSTER-TNT |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 124.587 | 124.587 | 2.620 |
High resolution limit [Å] | 2.489 | 7.870 | 2.489 |
Rmerge | 0.324 | 0.097 | 0.954 |
Total number of observations | 7492 | 34990 | |
Number of reflections | 34116 | ||
<I/σ(I)> | 5.8 | 11.5 | 2 |
Completeness [%] | 99.7 | 99.8 | 98 |
Redundancy | 7.3 | 6.4 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 291 | Sodium Citrate, Ammonium sulfate, Lithium sulfate, pH 5.5, vapor diffusion, hanging drop, temperature 291K |