Table 2. Diffraction and refinement data for the HDA15HD tetramer.
Statistics for the highest-resolution shell are shown in parentheses.
| Crystals | HDA15HD Tetramer |
|---|---|
| Beamline | NSRRC TPS 05A |
| Wavelength (Å) | 1.28198 |
| Data collecting and processing | |
| Space group | P 1 21 1 |
| Cell dimensions (Å and °) | 60.8, 78.8, 176.8 90, 94.2, 90 |
| Resolution (Å; last shell) | 29.55–2.36 (2.44–2.36) |
| Completeness (%; last shell) | 99.1 (97.1) |
| I/σ (last shell) | 13.9 (2.5) |
| Reflections (total/unique) | 274,152/26,756 |
| Redundancy | 3.1 (3.0) |
| Rmerge (%; last shell) | 9.1 (47.3) |
| Refinement | |
| Resolution (Å) | 29.52–2.36 |
| Rwork (%) | 16.7 |
| Rfree (%) | 21.8 |
| No. of nonhydrogen atoms | 11,022 |
| No. of protein atoms | 10,535 |
| No. of water | 439 |
| Protein residues | 1,404 |
| Model quality | |
| R.M.S. deviations | |
| Bond length (Å) | 0.008 |
| Bond angle (°) | 0.93 |
| Average B-factor (Å) | 28.13 |
| B-factor (macromolecules) | 28.07 |
| B-factor (ligands) | 45.62 |
| B-factor (solvent) | 27.53 |
| Ramachandranplot (%) | |
| Most favored | 95.68 |
| Allowed | 3.96 |
| Disallowed | 0.36 |