7PQS
SRPK1 in complex with MSC2711186
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-09-26 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 1.00 |
Spacegroup name | P 65 |
Unit cell lengths | 75.132, 75.132, 309.709 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.860 - 2.200 |
R-factor | 0.2008 |
Rwork | 0.199 |
R-free | 0.23560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5mxx |
RMSD bond length | 0.010 |
RMSD bond angle | 1.620 |
Data reduction software | XDS |
Data scaling software | Aimless (0.7.4) |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 49.810 | 49.810 | 2.270 |
High resolution limit [Å] | 2.200 | 9.070 | 2.200 |
Rmerge | 0.173 | 0.065 | 1.676 |
Rmeas | 0.177 | 0.066 | 1.723 |
Rpim | 0.039 | 0.014 | 0.399 |
Total number of observations | 1026667 | 15985 | 80156 |
Number of reflections | 50020 | 743 | 4334 |
<I/σ(I)> | 12.5 | 38.1 | 2 |
Completeness [%] | 100.0 | 99.5 | 100 |
Redundancy | 20.5 | 21.5 | 18.5 |
CC(1/2) | 0.998 | 0.999 | 0.723 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 278 | 15% PEG Smear Broad, 0.1M cacodylate, 5% tacsimate, 10% ethylene glycol |