3CKV
Crystal Structure of a Mycobacterial Protein
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-17 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.0053 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 86.967, 86.967, 103.932 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.480 - 2.000 |
R-factor | 0.22509 |
Rwork | 0.225 |
R-free | 0.24176 |
Structure solution method | Rigid body refinement |
RMSD bond length | 0.017 |
RMSD bond angle | 1.432 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.480 | |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 26692 | |
<I/σ(I)> | 4.5 | |
Redundancy | 9.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 1 M Ammonium sulphate, 0.1 M HEPES pH 7.0, 20 mM Manganese chloride, 1 mM Sodium thiosulphate, 100 mM uridine-5 -diphosphate-N-acetyl-glucosamine, VAPOR DIFFUSION, HANGING DROP, temperature 293K |