2FT6
Structure of Cu(II)azurin with the metal-binding loop sequence "CTFPGHSALM" replaced with "CTPHPM"
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX10.1 |
Synchrotron site | SRS |
Beamline | PX10.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-10-16 |
Detector | MARRESEARCH |
Wavelength(s) | 1.075 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 51.788, 51.788, 75.553 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.950 - 1.250 |
R-factor | 0.129 |
Rwork | 0.127 |
R-free | 0.15500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4azu Chain A |
RMSD bond length | 0.018 |
RMSD bond angle | 1.748 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.953 | 1.320 |
High resolution limit [Å] | 1.250 | 1.250 |
Rmerge | 0.060 | 0.291 |
Total number of observations | 38274 | |
Number of reflections | 29176 | 4155 |
<I/σ(I)> | 5.8 | 6.1 |
Completeness [%] | 99.9 | |
Redundancy | 10 | 9.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 0.1MM MES, 20% PEG6000, 0.2M LiCl, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |