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1FAD before refinement

- WHAT IF Z-SCORES -

Ramachandran plot appearance
-1.94 +/- 0.29
1st generation packing quality
-0.90 +/- 0.15
2nd generation packing quality
-2.35 +/- 0.34
chi-1/chi-2 rotamer normality
-0.56 +/- 0.51
Inside/Outside distribution
1.02 +/- 0.02
Backbone conformation
-3.25 +/- 0.60

- PROCHECK -

Most favoured regions
89.75 +/- 1.42
Allowed regions
8.25 +/- 1.64
Generously allowed regions
1.61 +/- 0.66
Disallowed regions
0.40 +/- 0.68

- COUNTS -

Number of bumps per 100 residues
59.70 +/- 5.10
Unsatisfied buried hydrogen donors
7.86 +/- 1.53
Unsatisfied buried hydrogen acceptors
0.48 +/- 0.68

- WHAT IF RMS Z-SCORES -

Bond lengths
1.01 +/- 0.01
Bond angles
1.32 +/- 0.01
Side chain planarity
3.64 +/- 0.14
Omega angle restraints
0.22 +/- 0.01
Improper dihedral distribution
1.00 +/- 0.02

less

1FAD after refinement

- WHAT IF Z-SCORES -

Ramachandran plot appearance
-3.58 +/- 0.23
1st generation packing quality
-1.01 +/- 0.15
2nd generation packing quality
-2.19 +/- 0.27
chi-1/chi-2 rotamer normality
-1.14 +/- 0.57
Inside/Outside distribution
1.01 +/- 0.02
Backbone conformation
-2.40 +/- 0.69

- PROCHECK -

Most favoured regions
88.10 +/- 1.56
Allowed regions
9.58 +/- 1.92
Generously allowed regions
1.36 +/- 0.39
Disallowed regions
1.02 +/- 0.67

- COUNTS -

Number of bumps per 100 residues
9.97 +/- 1.68
Unsatisfied buried hydrogen donors
6.05 +/- 1.77
Unsatisfied buried hydrogen acceptors
0.14 +/- 0.36

- WHAT IF RMS Z-SCORES -

Bond lengths
0.79 +/- 0.02
Bond angles
0.78 +/- 0.02
Side chain planarity
0.88 +/- 0.09
Omega angle restraints
0.80 +/- 0.03
Improper dihedral distribution
0.96 +/- 0.04

less

Contact: Chris Spronk - Sander Nabuurs.