1U6R
Transition state analog complex of muscle creatine kinase (R134K) mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-11-01 |
Detector | MARRESEARCH |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.689, 92.572, 165.553 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.000 - 1.650 |
R-factor | 0.16673 |
Rwork | 0.165 |
R-free | 0.20017 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1crk |
RMSD bond length | 0.008 |
RMSD bond angle | 1.214 |
Data reduction software | HKL-2000 |
Data scaling software | CCP4 ((TRUNCATE)) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.000 | 1.694 |
High resolution limit [Å] | 1.650 | 1.650 |
Number of reflections | 88822 | |
Completeness [%] | 84.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 20% PEG 8K, 25 mM ammonium acetate, 25 mM sodium nitrate and 0.1 M sodium cacodylate, pH 6.5., VAPOR DIFFUSION, HANGING DROP, temperature 293K |