Method to determine structure: MOLECULAR REPLACEMENT / Resolution: 1.84→38.92 Å / Cor.coef. Fo:Fc: 0.957 / Cor.coef. Fo:Fc free: 0.933 / SU B: 0.001 / SU ML: 0 / Cross valid method: THROUGHOUT / ESU R: 0.102 / ESU R Free: 0.128 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.20856
4619
5 %
RANDOM
Rwork
0.16694
-
-
-
all
0.17
95776
-
-
obs
0.16903
88210
97.93 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK
Displacement parameters
Biso mean: 18.823 Å2
Baniso -1
Baniso -2
Baniso -3
1-
0 Å2
0 Å2
0 Å2
2-
-
0 Å2
0 Å2
3-
-
-
0 Å2
Refinement step
Cycle: LAST / Resolution: 1.84→38.92 Å
Protein
Nucleic acid
Ligand
Solvent
Total
Num. atoms
8142
0
384
792
9318
LS refinement shell
Resolution: 1.84→1.888 Å / Total num. of bins used: 20
Rfactor
Num. reflection
% reflection
Rfree
0.404
293
-
Rwork
0.312
5411
-
obs
-
-
82.23 %
+
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