1NN6
Human Pro-Chymase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-1 |
Synchrotron site | SSRL |
Beamline | BL9-1 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1999-03-30 |
Detector | MARRESEARCH |
Wavelength(s) | 1.08 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 50.688, 55.639, 88.686 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.700 * - 1.750 |
R-factor | 0.20499 |
Rwork | 0.203 |
R-free | 0.24500 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1klt |
RMSD bond length | 0.017 |
RMSD bond angle | 1.800 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.700 | 1.770 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.040 | 0.690 * |
Total number of observations | 222007 * | |
Number of reflections | 27938 * | |
<I/σ(I)> | 26.8 | 1.7 |
Completeness [%] | 98.3 | 97.5 |
Redundancy | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 4 * | 20% Peg 4k, 150mM Na Formate, and 100 mM Tris , pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | 500 (mM) | ||
2 | 1 | drop | Bis-Tris | 2 (mM) | pH6.1 |
3 | 1 | drop | protein | 5.0 (mg/ml) | |
4 | 1 | reservoir | PEG4000 | 20 (%) | |
5 | 1 | reservoir | sodium formate | 150 (mM) | |
6 | 1 | reservoir | Tris | 100 (mM) | pH8.5 |