2X49
Crystal structure of the C-terminal domain of InvA
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-12-05 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 44.991, 57.413, 113.870 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.510 - 1.500 |
R-factor | 0.19346 |
Rwork | 0.192 |
R-free | 0.22516 |
Structure solution method | MAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.017 |
RMSD bond angle | 1.651 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | autoSHARP |
Refinement software | REFMAC (5.4.0074) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.570 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.010 | 0.020 |
Number of reflections | 44795 | |
<I/σ(I)> | 11.4 | 2 |
Completeness [%] | 93.3 | 93.3 |
Redundancy | 4.5 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.5 | 15-20 % PEG 500, 0.05 M CACL2, 0.1 M CITRATE PH 5.5 |