2YXL
Crystal Structure of PH0851
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-12-08 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.00 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 116.621, 116.621, 93.684 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.180 - 2.550 |
R-factor | 0.2139 |
Rwork | 0.212 |
R-free | 0.24575 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1sqf |
RMSD bond length | 0.007 |
RMSD bond angle | 1.113 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.071 | 0.803 |
Number of reflections | 37661 | |
<I/σ(I)> | 32.4 | 2.14 |
Completeness [%] | 99.4 | 98.7 |
Redundancy | 10.4 | 6.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 293 | 1.14M Na-Citrate, 0.08M Na-Hepes(pH 7.0), 8% 1.6-Hexanediol, 200mM NaCl, VAPOR DIFFUSION, temperature 293K |