1HJA
LYS 18 VARIANT OF TURKEY OVOMUCOID INHIBITOR THIRD DOMAIN COMPLEXED WITH ALPHA-CHYMOTRYPSIN
Experimental procedure
Source type | ROTATING ANODE |
Source details | OTHER |
Temperature [K] | 293 |
Detector technology | AREA DETECTOR |
Collection date | 1996-11-04 |
Detector | SIEMENS |
Spacegroup name | P 61 |
Unit cell lengths | 103.470, 103.470, 47.120 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 10.000 - 2.300 |
R-factor | 0.193 |
Rwork | 0.193 |
R-free | 0.24600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1cho |
RMSD bond length | 0.008 |
RMSD bond angle | 1.536 |
Data reduction software | XENGEN |
Data scaling software | XENGEN |
Phasing software | X-PLOR (3.843) |
Refinement software | X-PLOR (3.843) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 10.000 | 2.400 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.108 | |
Number of reflections | 11136 | |
<I/σ(I)> | 5.89 | |
Completeness [%] | 86.9 | 69.27 |
Redundancy | 8.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 0.1 M KH2PO4/K2HPO4 PH=6.0 10% PEG6000 |