7PQM
Acinetobacter baumannii DNA gyrase B 23kDa ATPase subdomain complexed with EBL2888
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-02-11 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 120.634, 48.293, 82.692 |
| Unit cell angles | 90.00, 123.85, 90.00 |
Refinement procedure
| Resolution | 43.540 - 1.550 |
| R-factor | 0.1823 |
| Rwork | 0.180 |
| R-free | 0.22350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7pqi |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.235 |
| Data reduction software | DIALS |
| Data scaling software | Aimless (0.7.7) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 43.500 | 43.500 | 1.580 |
| High resolution limit [Å] | 1.550 | 8.490 | 1.550 |
| Rmerge | 0.105 | 0.045 | 1.550 |
| Rmeas | 0.110 | 0.047 | 1.625 |
| Rpim | 0.033 | 0.014 | 0.482 |
| Total number of observations | 4016 | 30739 | |
| Number of reflections | 57543 | 384 | 2777 |
| <I/σ(I)> | 8.9 | 48.6 | 0.5 |
| Completeness [%] | 99.9 | 99.3 | 99 |
| Redundancy | 10.9 | 10.5 | 11.1 |
| CC(1/2) | 0.999 | 0.998 | 0.660 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | NULL |
