2GHZ
Crystal structure of Azurin Phe114Pro mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-10-14 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 35.350, 47.810, 132.520 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.800 - 1.600 |
R-factor | 0.14445 |
Rwork | 0.142 |
R-free | 0.19028 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4AZU - chain A |
RMSD bond length | 0.017 |
RMSD bond angle | 1.597 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.800 | 1.630 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.047 | 0.204 |
Number of reflections | 33091 | |
<I/σ(I)> | 27.4 | 4.8 |
Completeness [%] | 98.6 | 92.7 |
Redundancy | 6.9 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4 | 293 | 25% PEG1500, 100mM MMT buffer, pH 4, VAPOR DIFFUSION, HANGING DROP, temperature 293K |