Resolution: 3.15→48.4 Å / SU ML: 0.45 / σ(F): 0.09 / Phase error: 30.8 / Stereochemistry target values: ML Details: SF FILE CONTAINS FRIEDEL PAIRS UNDER I/F_MINUS AND I/F_PLUS COLUMNS.
Rfactor
Num. reflection
% reflection
Rfree
0.2787
1083
4.76 %
Rwork
0.2224
-
-
obs
0.2252
22751
97.9 %
Solvent computation
Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Refinement step
Cycle: LAST / Resolution: 3.15→48.4 Å
Protein
Nucleic acid
Ligand
Solvent
Total
Num. atoms
4669
0
0
0
4669
Refine LS restraints
Refine-ID
Type
Dev ideal
Number
X-RAY DIFFRACTION
f_bond_d
0.009
4752
X-RAY DIFFRACTION
f_angle_d
0.992
6403
X-RAY DIFFRACTION
f_dihedral_angle_d
14.372
1737
X-RAY DIFFRACTION
f_chiral_restr
0.051
724
X-RAY DIFFRACTION
f_plane_restr
0.006
809
LS refinement shell
Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 8