5B5J
Hen egg white lysozyme with boron tracedrug UTX-97
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-10-01 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 78.440, 78.440, 37.353 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 21.760 - 1.260 |
R-factor | 0.19424 |
Rwork | 0.193 |
R-free | 0.22334 |
RMSD bond length | 0.027 |
RMSD bond angle | 3.933 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 22.000 |
High resolution limit [Å] | 1.260 |
Number of reflections | 28368 |
<I/σ(I)> | 3 |
Completeness [%] | 93.7 |
Redundancy | 5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.7 | 283 | 0.1 M sodium acetatebuffer (pH4.7), 0.4M NaCl |