2ACP
Crystal structure of nitrophorin 2 aqua complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-BM-C |
Synchrotron site | APS |
Beamline | 14-BM-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-08-04 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 39.754, 125.642, 33.468 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.400 |
R-factor | 0.1872 |
Rwork | 0.185 |
R-free | 0.23279 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1euo |
RMSD bond length | 0.022 |
RMSD bond angle | 2.028 |
Data reduction software | XDISPLAYF |
Data scaling software | d*TREK |
Refinement software | REFMAC (5.2.0003) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.450 |
High resolution limit [Å] | 1.400 | 1.400 |
Number of reflections | 32453 | |
<I/σ(I)> | 25 | 2 |
Completeness [%] | 95.4 | 98 |
Redundancy | 7.3 | 6.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | sodium citrate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |