6L56
Fe(II) loaded Tegillarca granosa ferritin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-06-08 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97892 |
Spacegroup name | P 2 2 2 |
Unit cell lengths | 181.900, 182.000, 182.030 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.119 - 1.853 |
R-factor | 0.166751590386 |
Rwork | 0.165 |
R-free | 0.19577 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1rcd |
RMSD bond length | 0.006 |
RMSD bond angle | 0.732 |
Data reduction software | xia2 |
Data scaling software | HKL-3000 |
Phasing software | BALBES |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.880 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.145 | 0.718 |
Rmeas | 0.158 | 0.798 |
Rpim | 0.062 | 0.340 |
Number of reflections | 505323 | 24901 |
<I/σ(I)> | 11.429 | 1.833 |
Completeness [%] | 99.7 | 98.9 |
Redundancy | 6.2 | 6.2 |
CC(1/2) | 0.986 | 0.798 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 289 | 0.1M sodium cacodylate trihydrate pH 6.5, 30% v/v (+/-)-2-Methyl-2,4-pentanediol |