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1E3Y before refinement

- WHAT IF Z-SCORES -

Ramachandran plot appearance
-4.82 +/- 0.00
1st generation packing quality
-2.19 +/- 0.00
2nd generation packing quality
-4.37 +/- 0.00
chi-1/chi-2 rotamer normality
-4.35 +/- 0.00
Inside/Outside distribution
1.00 +/- 0.00
Backbone conformation
-3.82 +/- 0.00

- PROCHECK -

Most favoured regions
76.30 +/- 0.00
Allowed regions
19.60 +/- 0.00
Generously allowed regions
3.10 +/- 0.00
Disallowed regions
1.00 +/- 0.00

- COUNTS -

Number of bumps per 100 residues
143.27 +/- 0.00
Unsatisfied buried hydrogen donors
11.00 +/- 0.00
Unsatisfied buried hydrogen acceptors
2.00 +/- 0.00

- WHAT IF RMS Z-SCORES -

Bond lengths
0.97 +/- 0.00
Bond angles
1.43 +/- 0.00
Side chain planarity
3.23 +/- 0.00
Omega angle restraints
0.17 +/- 0.00
Improper dihedral distribution
1.05 +/- 0.00

less

1E3Y after refinement

- WHAT IF Z-SCORES -

Ramachandran plot appearance
-3.54 +/- 0.00
1st generation packing quality
-1.47 +/- 0.00
2nd generation packing quality
-3.04 +/- 0.00
chi-1/chi-2 rotamer normality
-2.05 +/- 0.00
Inside/Outside distribution
0.98 +/- 0.00
Backbone conformation
-4.32 +/- 0.00

- PROCHECK -

Most favoured regions
79.40 +/- 0.00
Allowed regions
18.60 +/- 0.00
Generously allowed regions
1.00 +/- 0.00
Disallowed regions
1.00 +/- 0.00

- COUNTS -

Number of bumps per 100 residues
23.08 +/- 0.00
Unsatisfied buried hydrogen donors
8.00 +/- 0.00
Unsatisfied buried hydrogen acceptors
1.00 +/- 0.00

- WHAT IF RMS Z-SCORES -

Bond lengths
1.00 +/- 0.00
Bond angles
1.00 +/- 0.00
Side chain planarity
1.05 +/- 0.00
Omega angle restraints
0.97 +/- 0.00
Improper dihedral distribution
1.10 +/- 0.00

less

Contact: Chris Spronk - Sander Nabuurs.