Monochromator: SI(111) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength
Wavelength: 0.9792 Å / Relative weight: 1
Reflection
Resolution: 2.2→30 Å / Num. obs: 38085 / % possible obs: 99.9 % / Observed criterion σ(I): -3 / Redundancy: 4.2 % / Rmerge(I) obs: 0.127 / Net I/σ(I): 11.28
Reflection shell
Resolution: 2.2→2.24 Å / Redundancy: 3.8 % / Rmerge(I) obs: 0.749 / Mean I/σ(I) obs: 1.96 / Num. unique obs: 1879 / CC1/2: 0.664 / % possible all: 100
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Processing
Software
Name
Version
Classification
PHENIX
1.11.1_2575
refinement
HKL-3000
datareduction
HKL-3000
datascaling
HKL-3000
phasing
SBC-Collect
datacollection
Refinement
Method to determine structure: SAD / Resolution: 2.201→29.632 Å / SU ML: 0.29 / Cross valid method: THROUGHOUT / σ(F): 0 / Phase error: 23.26 / Stereochemistry target values: ML