3IB8
Crystal structure of full length Rv0805 in complex with 5'-AMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE BW7A |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | BW7A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-28 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.9864 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 100.400, 100.400, 80.801 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.750 - 1.800 |
R-factor | 0.152 |
Rwork | 0.150 |
R-free | 0.16800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ib7 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.237 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.840 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.067 | 0.619 |
Number of reflections | 38865 | |
<I/σ(I)> | 9.7 | 3.8 |
Completeness [%] | 99.9 | 100 |
Redundancy | 8 | 7.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | Bis-Tris, amm. acetate, MPD, AMP, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |