Table 4.
X-ray data collection and refinement statistics.
| Bfl-1:dF1 PDB ID 6MBB |
Bfl-1:dF4 PDB ID 6MBC |
Mcl-1:dM1 PDB ID 6MBD |
Mcl-1:dM7 PDB ID 6MBE |
|
|---|---|---|---|---|
| Data Collection | ||||
| Space Group | P 1 21 1 | P 1 21 1 | P 21 21 21 | P 32 2 1 |
| Cell parameters | ||||
| a, b, c | 43.2 42.9 47.7 | 43.5 42.9 46.7 | 64.8 69.7 84.9 | 80.8 80.8 58.0 |
| α, β, γ | 90 115.96 90 | 90 114.2 90 | 90 90 90 | 90 90 120 |
| Rmeas | 0.078 (0.399) | 0.078 (0.43) | 0.137 (0.981) | 0.122 (.070) |
| Rpim | 0.029 (0.169) | 0.036 (0.259) | 0.047 (0.398) | 0.045 (0.338) |
| Mean I/σ(I) | 30.9 (2.9) | 22.4 (2.0) | 15.6 (0.66) | 18.3 (1.5) |
| Completeness (%) | 91.5 (77.8) | 94.6 (74.4) | 95.8 (67.3) | 97.3 (79.0) |
| Redundancy | 6.5 (4.3) | 4.1 (1.9) | 7.7 (3.9) | 6.7 (3.4) |
| Refinement | ||||
| Resolution (Å) | 38.86 - 1.59 (1.644 - 1.587) | 42.56 - 1.75 (1.815 - 1.752) | 24.3 - 1.95 (1.994 - 1.945) | 29.94 - 2.25 (2.327 - 2.247) |
| Unique Reflections | 19602 (1654) | 13573 (1193) | 25709 (1922) | 9363 (833) |
| Rwork/Rfree | 0.17/0.20 (0.24/0.26) | 0.18/0.21 (0.26/0.33) | 0.20/0.24 (0.33/0.37) | 0.12/0.22 (0.25/0.26) |
| Number of non-hydrogen atoms | 1623 | 1541 | 3047 | 1482 |
| Average B-factors RMSD | 30.2 | 42.2 | 35.8 | 49.1 |
| Bond lengths (Å) | 0.006 | 0.003 | 0.006 | 0.002 |
| Bond angles (°) | 0.77 | 0.54 | 0.74 | 0.41 |
Values in parentheses are for the highest-resolution shell.