3IUC
Crystal structure of the human 70kDa heat shock protein 5 (BiP/GRP78) ATPase domain in complex with ADP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-06-02 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.91841 |
Spacegroup name | P 1 |
Unit cell lengths | 48.212, 51.795, 94.994 |
Unit cell angles | 98.85, 94.88, 117.61 |
Refinement procedure
Resolution | 29.120 - 2.400 |
R-factor | 0.19365 |
Rwork | 0.190 |
R-free | 0.26981 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3i33 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.588 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0035) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 35.000 |
High resolution limit [Å] | 2.130 |
Rmerge | 0.130 |
Number of reflections | 41864 |
Completeness [%] | 94.4 |
Redundancy | 3.86 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 293 | 20% PEG 6000, 0.2M CaCl2, 0.1M NaAcetate, pH 5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |