4JP8
Crystal structure of Pro-F17H/S324A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-07-04 |
Detector | BRUKER SMART 6500 |
Wavelength(s) | 0.9 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 77.323, 92.498, 122.222 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.210 |
R-factor | 0.2324 |
Rwork | 0.230 |
R-free | 0.27990 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2e1p |
RMSD bond length | 0.008 |
RMSD bond angle | 0.980 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.240 |
High resolution limit [Å] | 2.200 | 5.970 | 2.200 |
Rmerge | 0.097 | 0.035 | 0.489 |
Number of reflections | 22172 | ||
<I/σ(I)> | 37.7 | ||
Completeness [%] | 99.5 | 97.5 | 99.5 |
Redundancy | 17.7 | 16 | 15.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277 | 20mM Tris-HCl pH7.0, 4M Sodium Formate , VAPOR DIFFUSION, SITTING DROP, temperature 277K |