9KZA
Crystal structure of TapT-Sinefungin complex from Escherichia coli
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-12-23 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97853 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 58.660, 41.980, 74.640 |
| Unit cell angles | 90.00, 97.40, 90.00 |
Refinement procedure
| Resolution | 23.910 - 1.940 |
| R-factor | 0.2187 |
| Rwork | 0.217 |
| R-free | 0.25580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.861 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHENIX (V1.21.2-5419) |
| Refinement software | PHENIX (V1.21.2-5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.910 | 1.990 |
| High resolution limit [Å] | 1.940 | 1.940 |
| Rmerge | 0.090 | 1.153 |
| Number of reflections | 26871 | 1954 |
| <I/σ(I)> | 10.1 | 1.6 |
| Completeness [%] | 99.4 | 98.9 |
| Redundancy | 6.6 | 6.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 0.1 M Magnesium acetate tetrahydrate, 0.1 M Ammonium sulfate, 0.1 M Sodium citrate pH 6.5, 29% w/v PEG 4000 |
