4WX3
pore-forming thermostable direct hemolysin from Grimontia hollisae
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-01-15 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9789, 0.9790, 0.9639 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 105.297, 112.588, 60.803 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.848 - 1.701 |
R-factor | 0.202 |
Rwork | 0.201 |
R-free | 0.23360 |
Structure solution method | MAD |
RMSD bond length | 0.005 |
RMSD bond angle | 0.847 |
Data reduction software | SCALEPACK (2000) |
Phasing software | PHENIX (1.9-1692) |
Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.064 | 0.570 |
Number of reflections | 73925 | |
<I/σ(I)> | 4.3 | 4.3 |
Completeness [%] | 92.2 | 79.3 |
Redundancy | 4.9 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 28%(v/v) PEG 400, 0.2 M CaCl2, 0.1 M Na-HEPES buffer |