4CK4
Ovine beta-Lactoglobulin at Atomic Resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.2 |
Synchrotron site | SRS |
Beamline | PX14.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2000-11-11 |
Detector | MARRESEARCH |
Spacegroup name | P 1 |
Unit cell lengths | 37.148, 49.031, 49.053 |
Unit cell angles | 69.75, 69.08, 77.56 |
Refinement procedure
Resolution | 14.700 - 1.120 |
R-factor | 0.14078 |
Rwork | 0.139 |
R-free | 0.16942 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1gxa |
RMSD bond length | 0.010 |
RMSD bond angle | 1.926 |
Data reduction software | DENZO |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 1.140 |
High resolution limit [Å] | 1.120 | 1.120 |
Rmerge | 0.050 | 1.230 |
Number of reflections | 116059 | |
<I/σ(I)> | 9.4 | 3.7 |
Completeness [%] | 92.3 | 89.4 |
Redundancy | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.6 | 0.2M SODIUM CITRATE, 0.1M SODIUM POTASSIUM TARTRATE, 2.0M AMMONIUM SULPHATE, PH 5.6 |