6TGT
The Calcium soaked crystal structure of the DPS2 from DEINOCOCCUS RADIODURANS to 2.16A resolution (Soaked in CaCl2 [5mM] for 20 min).
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2005-12-07 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9537 |
Spacegroup name | P 2 3 |
Unit cell lengths | 88.342, 88.342, 88.342 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.210 - 2.155 |
R-factor | 0.2084 |
Rwork | 0.207 |
R-free | 0.23410 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2c2j |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 51.000 | 51.000 | 2.220 |
High resolution limit [Å] | 2.155 | 8.890 | 2.155 |
Rmerge | 0.127 | 0.042 | 1.441 |
Rmeas | 0.133 | 0.045 | 1.580 |
Rpim | 0.041 | 0.017 | 0.479 |
Number of reflections | 12682 | 209 | 1059 |
<I/σ(I)> | 17.2 | 63.8 | 2 |
Completeness [%] | 100.0 | 99 | 100 |
Redundancy | 10.6 | 7.9 | 10.7 |
CC(1/2) | 0.998 | 0.995 | 0.721 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.1 M KCl, 0.01 M MgCl2, 0.05 M HEPES pH 7.0, 5% v/v PEG 400 (Hampton Natrix crystal screen # 35) |