3AMC
Crystal structures of Thermotoga maritima Cel5A, apo form and dimer/au
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-05-29 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.919, 78.340, 62.983 |
Unit cell angles | 90.00, 97.25, 90.00 |
Refinement procedure
Resolution | 25.000 - 1.400 |
Rwork | 0.184 |
R-free | 0.20860 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.023 |
RMSD bond angle | 2.100 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 1.450 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.048 | 0.186 |
Number of reflections | 118042 | |
<I/σ(I)> | 6.7 | |
Completeness [%] | 99.4 | 100 |
Redundancy | 3.8 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 0.4M NaCl, 0.1M Tris, 32% PEG 3350, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |