Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength
Wavelength: 1.54178 Å / Relative weight: 1
Reflection
Resolution: 2.78→44.61 Å / Num. obs: 10186 / % possible obs: 97.3 %
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Phasing
Phasing
Method: molecular replacement
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Processing
Software
Name
Version
Classification
NB
REFMAC
5.8.0158
refinement
PDB_EXTRACT
3.23
dataextraction
MOSFLM
datareduction
SCALA
datascaling
Refinement
Method to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.78→44.61 Å / Cor.coef. Fo:Fc: 0.929 / Cor.coef. Fo:Fc free: 0.879 / SU B: 14.498 / SU ML: 0.282 / Cross valid method: THROUGHOUT / σ(F): 0 / ESU R Free: 0.395 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.234
510
4.8 %
RANDOM
Rwork
0.188
-
-
-
obs
0.19
10186
97.3 %
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Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK