Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength
Wavelength: 0.987 Å / Relative weight: 1
Reflection
Resolution: 1.5→25 Å / Num. obs: 40012 / % possible obs: 96.1 % / Redundancy: 5.3 % / Net I/σ(I): 15.6
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Processing
Software
Name
Version
Classification
REFMAC
5.7.0029
refinement
XSCALE
datascaling
PHENIX
phasing
Coot
modelbuilding
Refinement
Resolution: 1.5→25 Å / Cor.coef. Fo:Fc: 0.949 / Cor.coef. Fo:Fc free: 0.928 / SU B: 1.574 / SU ML: 0.059 / Cross valid method: THROUGHOUT / ESU R: 0.093 / ESU R Free: 0.092 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.23695
2001
5 %
RANDOM
Rwork
0.20638
-
-
-
obs
0.2079
38011
96.2 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: BABINET MODEL WITH MASK