6VO4
Crystal Structure Analysis of BFL1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-11-16 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9791 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 39.550, 43.240, 43.490 |
Unit cell angles | 90.00, 104.90, 90.00 |
Refinement procedure
Resolution | 38.220 - 1.740 |
R-factor | 0.2409 |
Rwork | 0.239 |
R-free | 0.28310 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5whh |
Data reduction software | XDS |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 38.220 | 38.230 | 1.770 |
High resolution limit [Å] | 1.740 | 4.720 | 1.740 |
Rmeas | 0.063 | 0.042 | 1.990 |
Rpim | 0.035 | 0.024 | 1.068 |
Total number of observations | 43051 | 2090 | 2190 |
Number of reflections | 13579 | 668 | 653 |
<I/σ(I)> | 11.2 | 30.7 | 0.7 |
Completeness [%] | 92.3 | 87.3 | 92.9 |
Redundancy | 3.2 | 3.1 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 3.5M Sodium formate, pH 7.0 |