5XEO
Crystal structure of a hydrogen sulfide-producing enzyme (Fn1220) from Fusobacterium nucleatum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2009-12-16 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 1.0 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 116.822, 116.822, 99.186 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 63.500 - 2.030 |
R-factor | 0.17041 |
Rwork | 0.168 |
R-free | 0.21259 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.551 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.500 | 2.080 |
High resolution limit [Å] | 2.030 | 2.030 |
Rmerge | 0.061 | 0.239 |
Number of reflections | 44852 | 3255 |
<I/σ(I)> | 42.9 | 17.2 |
Completeness [%] | 99.9 | 100 |
Redundancy | 26.3 | 25.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 41% (v/v) PEG 600, 0.1M Hepes pH 7.5, 0.17M Calcium acetate |