7FBL
Thrombocorticin in complex with Ca2+ and mannose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NE3A |
Synchrotron site | Photon Factory |
Beamline | AR-NE3A |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-11-09 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.00 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 41.570, 44.980, 109.260 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.082 - 1.419 |
R-factor | 0.1624 |
Rwork | 0.162 |
R-free | 0.18190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7f9f |
RMSD bond length | 0.007 |
RMSD bond angle | 0.965 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 54.630 | 1.500 |
High resolution limit [Å] | 1.419 | 1.419 |
Number of reflections | 39544 | 6240 |
<I/σ(I)> | 22.27 | |
Completeness [%] | 99.7 | |
Redundancy | 9.51 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | sodium acetate, PEG 3350, PEG 400 |