Table 1.
X-ray data collection and refinement statistics
| Structure | StaL–PAP–Desulfo-A47934 |
| Space group | P212121 |
| a, b, c, Å | 53.4, 82.6, 123.1 |
| Wavelength, Å | 0.97949 |
| Resolution, Å | 50–2.70 (2.80–2.70) |
| No. of observed hkl | 92,767 |
| Unique hkl | 15,536 (1,544) |
| Redundancy | 6.0 (5.9) |
| Completeness, % | 99.9 (100) |
| Rsym* | 0.076 (0.533) |
| I/(σI) | 32.4 (4.2) |
| Wilson B, Å2 | 69.4 |
| Rwork† (no. of hkl) | 0.223 (14,661) |
| Rfree (no of hkl) | 0.272 (773) |
| B-factors (no. of atoms) | |
| Protein | 64.9 (3,776) |
| Solvent | 42.0 (10) |
| PAP | 58.0 (27) |
| DSA | 85.5 (86) |
| Ramachandran, % | |
| Allowed | 98.1 |
| Generous | 1.2 |
| Disallowed | 0.7 |
| RMSD | |
| Bonds, Å | 0.015 |
| Angles, ° | 1.66 |
| PDB ID code | 4EEC |
*
†
.