4D9F
D-Cysteine desulfhydrase from Salmonella typhimurium complexed with D-cycloserine (DCS)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2010-01-07 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 66.160, 167.510, 68.773 |
Unit cell angles | 90.00, 121.28, 90.00 |
Refinement procedure
Resolution | 58.740 - 2.610 |
R-factor | 0.23108 |
Rwork | 0.228 |
R-free | 0.28329 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4d8t |
RMSD bond length | 0.005 |
RMSD bond angle | 1.033 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 58.780 | 2.730 |
High resolution limit [Å] | 2.590 | 2.590 |
Rmerge | 0.073 | 0.161 |
Number of reflections | 32824 | |
<I/σ(I)> | 9 | 4 |
Completeness [%] | 83.0 | 66.4 |
Redundancy | 2.4 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.6 | 298 | 1.5M Ammonium sulphate, 15% (v/v) ethylene glycol, 0.1M HEPES, 0.2% Benzamidine, pH 8.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K |