9MTU
Crystal structure of apo-ADC-1 beta-lactamase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-11-17 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.95369 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.144, 181.981, 50.334 |
| Unit cell angles | 90.00, 99.43, 90.00 |
Refinement procedure
| Resolution | 38.550 - 1.300 |
| R-factor | 0.1538 |
| Rwork | 0.152 |
| R-free | 0.18800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.792 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.600 | 1.320 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmeas | 0.078 | |
| Rpim | 0.029 | 0.447 |
| Number of reflections | 179263 | 8242 |
| <I/σ(I)> | 12.2 | 1.4 |
| Completeness [%] | 96.0 | |
| Redundancy | 7 | |
| CC(1/2) | 0.999 | 0.718 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M lithium chloride, 20% PEG 3350 |
