3ACS
Crystal Structure of Cellvibrio gilvus Cellobiose Phosphorylase W488F mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-12-14 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 84.796, 98.139, 104.376 |
Unit cell angles | 90.00, 102.57, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.510 |
R-factor | 0.14555 |
Rwork | 0.142 |
R-free | 0.21129 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2cqs |
RMSD bond length | 0.017 |
RMSD bond angle | 1.595 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.106 | 0.311 |
Number of reflections | 57216 | |
<I/σ(I)> | 14.2 | 2.89 |
Completeness [%] | 99.8 | 99.8 |
Redundancy | 3.4 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 277 | ammonium sulfate, VAPOR DIFFUSION, temperature 277K |