6JSB
Crystal structure of Heme binding protein HtaB from Corynebacterium glutamicum
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 | 2016-07-20 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 235.170, 33.730, 126.620 |
Unit cell angles | 90.00, 121.14, 90.00 |
Refinement procedure
Resolution | 38.091 - 1.699 |
R-factor | 0.1778 |
Rwork | 0.177 |
R-free | 0.19780 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6DSA |
RMSD bond length | 0.017 |
RMSD bond angle | 1.491 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.091 | 1.760 |
High resolution limit [Å] | 1.699 | 1.700 |
Rmerge | 0.073 | 0.563 |
Rmeas | 0.086 | 0.660 |
Rpim | 0.045 | 0.341 |
Number of reflections | 94191 | 9232 |
<I/σ(I)> | 11.7 | 2.4 |
Completeness [%] | 98.9 | 98.1 |
Redundancy | 3.7 | 3.7 |
CC(1/2) | 0.997 | 0.946 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 38 % 2-ethoxyethanol, 0.1 M Tris-HCl pH7.5, 0.05 M calcium acetate |