3AMG
Crystal structures of Thermotoga maritima Cel5A in complex with Cellobiose substrate, mutant form
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 | 2010-07-20 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 60.979, 73.356, 62.192 |
Unit cell angles | 90.00, 97.57, 90.00 |
Refinement procedure
Resolution | 25.000 - 2.400 |
Rwork | 0.233 |
R-free | 0.28430 |
Structure solution method | MOLECULAR REPLACEMENT |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASES |
Refinement software | CNS (1.21) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.490 |
High resolution limit [Å] | 2.387 | 2.400 |
Number of reflections | 21337 | |
<I/σ(I)> | 30.5 | 3.6 |
Completeness [%] | 98.7 | 93.4 |
Redundancy | 3.7 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | VAPOR DIFFUSION, SITTING DROP, temperature 298K |