Crystal structure of anti- MERS-CoV human neutralizing LCA60 antibody Fab fragment |
This entry was created with PDB-REDO version 8.03. |
From original header | |||||||
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Spacegroup | P 1 21 1 | a: 70.725 Å | b: 69.575 Å | c: 93.838 Å | α: 90.00° | β: 107.65° | γ: 90.00° |
Resolution | 3.00 Å | Reflections | 17494 | Test set | 873 (5.0%) | ||
R | 0.2280 | R-free | 0.2827 | ||||
According to PDB-REDO | |||||||
Resolution | 3.00 Å | Reflections | 17494 | Test set | 873 (5.0%) | Twin | false |
PDB-REDO files | |||||||
Re-refined and rebuilt structure | Re-refined (only) structure |
All files
(compressed) |
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Links | |||||||
PDBe | RCSB PDB | 3D bionotes | Proteopedia |
Original | PDB-REDO | |
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Crystallographic refinement | ||
R | 0.2282 | 0.2313 |
R-free | 0.2835 | 0.2857 |
Bond length RMS Z-score | 1.293 | 0.352 |
Bond angle RMS Z-score | 0.880 | 0.586 |
Model quality | ||
Ramachandran plot normality | -1.137 49 | -2.393 23 |
Rotamer normality | -0.073 91 | -3.990 26 |
Coarse packing | -0.310 46 | -0.219 50 |
Fine packing | -0.139 80 | -0.284 76 |
Bump severity | 0.011 56 | 0.035 26 |
Hydrogen bond satisfaction | 0.871 22 | 0.850 13 |
WHAT_CHECK | Report | Report |
Kleywegt-like plot |
Description | Count |
---|---|
Rotamers changed | 15 |
Side chains flipped | 0 |
Waters removed | 0 |
Peptides flipped | 8 |
Chiralities fixed | 0 |
Residues fitting density better | 0 |
Residues fitting density worse | 0 |