7F4R
Crystal structure of MTA1
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 | 2021-05-22 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.97915 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.872, 112.947, 81.851 |
Unit cell angles | 90.00, 97.81, 90.00 |
Refinement procedure
Resolution | 28.730 - 1.830 |
R-factor | 0.211 |
Rwork | 0.210 |
R-free | 0.24060 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7f4o |
RMSD bond length | 0.014 |
RMSD bond angle | 1.404 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.860 |
High resolution limit [Å] | 1.830 | 1.830 |
Rpim | 0.049 | 0.410 |
Number of reflections | 54422 | 3299 |
<I/σ(I)> | 11.79 | 1.43 |
Completeness [%] | 92.4 | |
Redundancy | 5.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.15M potassium sodium tartrate, 18% PEG 3350 |