3DWG
Crystal structure of a sulfur carrier protein complex found in the cysteine biosynthetic pathway of Mycobacterium tuberculosis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-08-22 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 55.810, 80.426, 89.619 |
Unit cell angles | 90.00, 105.74, 90.00 |
Refinement procedure
Resolution | 27.130 - 1.530 |
R-factor | 0.178 |
Rwork | 0.176 |
R-free | 0.21700 |
Structure solution method | SAD |
RMSD bond length | 0.020 |
RMSD bond angle | 1.899 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SHARP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.570 |
High resolution limit [Å] | 1.530 | 1.530 |
Number of reflections | 105098 | |
<I/σ(I)> | 26.2 | 4 |
Completeness [%] | 96.3 | 81.6 |
Redundancy | 3.18 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.8 | 295 | 7-10% w/v PEG 4000, 0.1 M Sodium citrate pH 5.8, 0.2 M Ammonium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 295K, pH 5.80 | |
1 | 5.8 | 295 | 7-10% w/v PEG 4000, 0.1 M Sodium citrate pH 5.8, 0.2 M Ammonium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 295K, pH 5.80 | |
1 | 5.8 | 295 | 7-10% w/v PEG 4000, 0.1 M Sodium citrate pH 5.8, 0.2 M Ammonium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 295K, pH 5.80 |