Optimised PDB entry 1ehz



Warnings!

Structure
SpacegroupP 1 21 1
Cell dimensionsa: 54.981 Åb: 33.389 Åc: 61.921 Å
α: 90.00°β: 90.20°γ: 90.00°
Resolution1.93 Å

Experimental data
ReflectionsAll: 15371Test set: 0 (0.0%)
Resolution range25.09 Å1.93 Å

R-values etc.
From PDB headerCalculated from dataAfter re-refinementAfter re-refinement and rebuilding
R0.23300.23840.19380.1998
R-free0.25300.23500.23190.2442
σR-free 0.00750.00740.0078
Z(R-free) 8.331.340.65

WHAT_CHECK validation
Original PDB entryRe-refined (only)Re-refined and rebuilt
1st generation packing quality1NANANA
2nd generation packing quality1NANANA
Ramachandran plot appearance1NANANA
Chi-1/Chi-2 rotamer normality1NANANA
Backbone conformation1NANANA
Bond length RMS Z-score21.1990.6690.703
Bond angle RMS Z-score20.9381.0011.022
Total number of bumps3443535
Unsatisfied H-bond donors/acceptors3000
LinkLinkLink

1 Higher is better, 2 Should be lower than 1.000, 3 Fewer is better


Density map fit (real-space correlation coefficient)
Significantly improved residues57
Significantly deteriorated residues0
Changes of all residuesPlot

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