9E58
YscN Yersinia ATPase delta 1-92
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2021-07-12 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 |
| Unit cell lengths | 46.604, 59.863, 65.062 |
| Unit cell angles | 94.01, 89.98, 99.00 |
Refinement procedure
| Resolution | 27.590 - 2.000 |
| R-factor | 0.1666 |
| Rwork | 0.164 |
| R-free | 0.21850 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.846 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmeas | 0.079 | 0.328 |
| Rpim | 0.040 | 0.178 |
| Number of reflections | 44287 | 4011 |
| <I/σ(I)> | 17.88 | 3.7 |
| Completeness [%] | 94.6 | 86.4 |
| Redundancy | 3.8 | |
| CC(1/2) | 0.992 | 0.914 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 2:1.5:1 well:protein:additive drop ratios. 29% PEG 3350; 0.18 M Ammonium Sulfate; 0.1 M HEPES, pH 7.5. 0.1 M spermidine (additive) |
