7XFS
MucP PDZ1 domain
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 | 2017-04-14 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.97915 |
Spacegroup name | P 21 2 21 |
Unit cell lengths | 34.640, 49.466, 100.245 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.470 - 1.060 |
R-factor | 0.151 |
Rwork | 0.150 |
R-free | 0.17340 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3id1 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.942 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.080 |
High resolution limit [Å] | 1.060 | 1.060 |
Rpim | 0.024 | 0.175 |
Number of reflections | 78318 | 3570 |
<I/σ(I)> | 30.5 | 3.5 |
Completeness [%] | 98.8 | 91.2 |
Redundancy | 6.1 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 40% PEG 300, 0.1M sodium arsenate pH 6.5, 0.2M calcium acetate |