4DQJ
Structural Investigation of Bacteriophage Phi6 Lysin (in complex with chitotetraose)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Collection date | 2011-01-01 |
Wavelength(s) | 1.075 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.816, 50.936, 65.020 |
Unit cell angles | 90.00, 103.48, 90.00 |
Refinement procedure
Resolution | 32.040 - 1.230 |
R-factor | 0.152 |
Rwork | 0.150 |
R-free | 0.17000 |
Structure solution method | SAD |
RMSD bond length | 0.011 |
RMSD bond angle | 1.800 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.250 |
High resolution limit [Å] | 1.230 | 3.340 | 1.230 |
Rmerge | 0.060 | 0.035 | 0.998 |
Number of reflections | 77799 | ||
<I/σ(I)> | 10.8 | ||
Completeness [%] | 95.5 | 92.8 | 83.5 |
Redundancy | 3.4 | 3.3 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.9 | 289 | 16% PEG 3350, 0.2 M potassium nitrate, pH 6.9, VAPOR DIFFUSION, HANGING DROP, temperature 289K |