Resolution: 2.75→2.9 Å / Redundancy: 5.4 % / Rmerge(I) obs: 0.9 / Mean I/σ(I) obs: 1.9 / CC1/2: 0.53 / % possible all: 100
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Processing
Software
Name
Version
Classification
REFMAC
5.7.0032
refinement
SCALEPACK
datascaling
MOLREP
phasing
Refinement
Method to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.75→39.65 Å / Cor.coef. Fo:Fc: 0.947 / Cor.coef. Fo:Fc free: 0.925 / SU B: 15.159 / SU ML: 0.298 / Cross valid method: THROUGHOUT / ESU R Free: 0.374 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.25499
1468
5.1 %
RANDOM
Rwork
0.21629
-
-
-
obs
0.21822
27409
99.77 %
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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