4CG3
Structural and functional studies on a thermostable polyethylene therephtalate degrading hydrolase from Thermobifida fusca
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector | MARRESEARCH |
Spacegroup name | I 41 |
Unit cell lengths | 117.900, 117.900, 36.440 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.122 - 1.550 |
R-factor | 0.1202 |
Rwork | 0.117 |
R-free | 0.14920 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1jfr |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 23.000 | 1.580 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.100 | 0.590 |
Number of reflections | 36710 | |
<I/σ(I)> | 7.6 | 2.4 |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.8 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |