X-RAY DIFFRACTION

Crystallization Details
Method pH Temprature Details
X-RAY DIFFRACTION 5.5 295 Protein solution: 0.3M NaCl, 10mM HEPES (pH 7.5); Screen solution: 20% PEG-3350, 0.2M Sodium Sulphate,0.1M B-Tris (pH 5.5); Freezing: Paratone, VAPOR DIFFUSION, HANGING DROP, temperature 295K
Unit Cell:
a: 75.897 Å b: 132.819 Å c: 151.791 Å α: 90.00° β: 90.00° γ: 90.00°
Symmetry:
Space Group: P 21 21 21
Crystal Properties:
Matthew's Coefficient: 1.96 Solvent Content: 37.18
Refinement Statistics
Diffraction ID Structure Solution Method Cross Validation Method Resolution Limit (High) Resolution Limit (Low) Number of Reflections (Observed) Number of Reflections (R-free) Percent Reflections (Observed) R-Work R-Free Mean Isotropic
X-RAY DIFFRACTION SAD THROUGHOUT 2.15 29.83 78544 4153 98.62 0.17096 0.21520 18.788
Data Collection
Overall
Resolution Limit (High) Resolution Limit (Low) Percent Possible (Observed) R Merge I (Observed) R Sym I (Observed) Net I Over Average Sigma (I) Redundancy Number Reflections (All) Number Reflections (Observed) Observed Criterion Sigma (F) Observed Criterion Sigma (I) B (Isotropic) From Wilson Plot
2.15 30.0 98.9 0.088 ? 43.5 14.9 82913 82913 ? -3.0 29.6
Highest Resolution Shell
# Resolution Limits (Low) Resolution Limits (High) Percent Possible (All) Percent Possible (Observed) R-Sym I (Observed) Mean I Over Sigma (Observed) Redundancy Number Unique Reflections (All)
1 2.15 2.19 98.2 ? ? 6.1 14.6 4069
Diffraction
Diffraction experiment
Crystal ID Scattering Type Data Collection Temprature Detector Detector Type Details Collection Date Monochromator Protocol
1 100 K
Radiation Source
Source Type Wavelength List Synchrotron Site Beamline
SYNCHROTRON APS BEAMLINE 21-ID-D 0.97925 APS 21-ID-D
Software
Software Name Purpose Version
Blu-Ice data collection Max
SHARP phasing .
REFMAC refinement 5.5.0051
HKL-2000 data reduction .
HKL-2000 data scaling .
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