5TZP
Crystal structure of FPV039:Bik BH3 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-05-04 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9537 |
Spacegroup name | P 43 |
Unit cell lengths | 47.848, 47.848, 74.303 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.229 - 1.350 |
R-factor | 0.1479 |
Rwork | 0.147 |
R-free | 0.17160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | FPV039 |
RMSD bond length | 0.024 |
RMSD bond angle | 1.831 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.850 | 1.370 |
High resolution limit [Å] | 1.350 | 1.350 |
Rmerge | 0.070 | 1.600 |
Number of reflections | 36707 | |
<I/σ(I)> | 24.1 | 1.7 |
Completeness [%] | 100.0 | 100 |
Redundancy | 14.5 | 13.6 |
CC(1/2) | 1.000 | 0.598 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.8 | 293 | 0.2M Lithium Chloride, 20% w/v PEG 3350 |