Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-02-08 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | H 3 |
Unit cell lengths | 106.487, 106.487, 90.229 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.080 - 1.450 |
R-factor | 0.13462 |
Rwork | 0.133 |
R-free | 0.17253 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1u9t |
RMSD bond length | 0.011 |
RMSD bond angle | 1.365 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.080 | 1.490 |
High resolution limit [Å] | 1.450 | 1.450 |
Rmerge | 0.070 | |
Number of reflections | 67643 | |
<I/σ(I)> | 38 | 1.8 |
Completeness [%] | 98.7 | 97.3 |
Redundancy | 6.8 | 6.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 277 | 20MG/ML PROTEIN, 12-15% PEG 0.15-0.2M MAGNESIUM FORMATE, AND 10-20MM NAD, PH 8.0, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 277K |