4NWB
Crystal structure of Mrt4
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-05-07 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.979214 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 61.292, 65.271, 71.404 |
Unit cell angles | 90.00, 111.03, 90.00 |
Refinement procedure
Resolution | 43.020 - 1.800 |
R-factor | 0.182 |
Rwork | 0.181 |
R-free | 0.20550 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.026 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | AutoSol |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.023 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.062 | 0.550 |
Number of reflections | 23803 | |
<I/σ(I)> | 17.8 | 3.5 |
Completeness [%] | 97.7 | 96.8 |
Redundancy | 7.6 | 7.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9 | 291 | 0.1 M bicine, 2.22 M (NH4)2SO4, pH 9.0, VAPOR DIFFUSION, SITTING DROP, temperature 291K |