3WAT
Crystal structure of 4-O-beta-D-mannosyl-D-glucose phosphorylase MGP complexed with Man+Glc
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-11-19 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9000 |
Spacegroup name | H 3 |
Unit cell lengths | 82.540, 82.540, 307.480 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 25.623 - 1.600 |
R-factor | 0.1629 |
Rwork | 0.162 |
R-free | 0.17530 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1vkd |
RMSD bond length | 0.007 |
RMSD bond angle | 1.119 |
Data reduction software | MOSFLM |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.320 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.101 | 0.278 |
Number of reflections | 103109 | |
<I/σ(I)> | 4.9 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 5.8 | 5.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.15 | 291 | 2.0M ammonium sulfate, 2.0M ammonium diphosphate, pH 5.15, VAPOR DIFFUSION, HANGING DROP, temperature 291K |