7ASC
TGFBIp mutant A546T
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
Synchrotron site | PETRA III, EMBL c/o DESY |
Beamline | P13 (MX1) |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-09-07 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9763 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 206.760, 206.760, 127.540 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 80.310 - 4.800 |
R-factor | 0.251 |
Rwork | 0.250 |
R-free | 0.25870 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5nv6 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.412 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.310 | 4.973 |
High resolution limit [Å] | 4.800 | 4.800 |
Rmerge | 0.139 | 2.900 |
Number of reflections | 14000 | 1376 |
<I/σ(I)> | 11.1 | |
Completeness [%] | 99.7 | |
Redundancy | 13 | |
CC(1/2) | 0.999 | 0.390 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 9 | 292 | 25 mM BIS-TRIS propane pH 9.0, 5% v/v PEG-mme 550, 1% PEG 3350 |