3ID1
Crystal Structure of RseP PDZ1 domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR-H |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-08-05 |
Detector | BRUKER SMART 6000 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 59.740, 59.740, 61.693 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.870 - 1.670 |
R-factor | 0.1951 |
Rwork | 0.193 |
R-free | 0.23620 |
Structure solution method | SAD |
RMSD bond length | 0.004 |
RMSD bond angle | 0.847 |
Data reduction software | SAINT |
Data scaling software | PROTEUM PLUS (PLUS) |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.770 |
High resolution limit [Å] | 1.670 | 1.670 |
Rmerge | 0.390 | |
Total number of observations | 89799 | |
Number of reflections | 14152 | |
<I/σ(I)> | 26.9 | 3.2 |
Completeness [%] | 93.1 | 93.1 |
Redundancy | 5.91 | 1.75 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 291 | 100mM Bis-tris propane, pH7.0, 2.5M (NH4)2SO4, VAPOR DIFFUSION, HANGING DROP, temperature 291K |