Table 1.
Data collection | AFF4-P-TEFb-AMPPNP |
Space group | P212121 |
Cell dimensions: a, b, c | 100.691, 126.298, 195.626 |
Resolution (Å)* | 50-2.94 (2.99–2.94) |
Unique reflections* | 54,189 (2664) |
Rsym (%)* | 9.3 (>100) |
I/σ(I)* | 23.2 (1.3) |
Completeness (%)* | 100.0 (100.0) |
Redundancy* | 8.1 (7.5) |
Temperature (K) | 100 |
Mosaicity (°) | 0.45–0.6 |
Refinement | |
Resolution (Å) | 48.7-2.94 |
No. reflections | 53,775 |
Rwork/Rfree | 0.207/0.245 |
No. atoms/B-factors (Å2) | |
CDK9, molecule 1, 2, 3 | 2558 (111.9), 2533 (116.3), 2558 (121.6) |
Cyclin T1, molecule 1, 2, 3 | 2003 (121.3), 2024 (123.1), 2001 (118.5) |
AFF4, molecule 1, 2, 3 | 248 (156.3), 421 (161.1), 243 (160.3) |
Water | 19 (90.1) |
Root mean square deviations | |
Bond lengths (Å) | 0.004 |
Bond angles (°) | 0.666 |
Ramachandran plot† | |
Favored (%) | 94.7 |
Allowed (%) | 4.48 |
Disallowed (%) | 0.78 |
Protein Data Bank ID | 4IMY |
Values in parentheses are for the highest resolution shell.
Values from MOLPROBITY.