6BSC
Crystal structure of the Mucin-1 SEA domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-06-17 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.9184 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 43.880, 43.880, 82.300 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.360 - 1.303 |
R-factor | 0.1576 |
Rwork | 0.156 |
R-free | 0.18390 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.825 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (dev_2456) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 30.000 | 30.000 | 1.320 |
High resolution limit [Å] | 1.300 | 3.530 | 1.300 |
Rmerge | 0.055 | 0.043 | 0.322 |
Rmeas | 0.058 | 0.045 | 0.359 |
Rpim | 0.017 | 0.014 | 0.153 |
Number of reflections | 23181 | 1198 | 1098 |
<I/σ(I)> | 15.4 | ||
Completeness [%] | 99.3 | 92.4 | 95.6 |
Redundancy | 10.8 | 9.1 | 4.9 |
CC(1/2) | 0.999 | 0.917 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | Drop was a 1:1 mix of protein (10 mg/ml in 10 mM Tris-Cl, pH 7.4) and reservoir solution (0.1 M sodium acetate trihydrate pH 4.6, 2.0 M sodium chloride) |