3OP5
Human vaccinia-related kinase 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 200 |
Detector technology | CCD |
Collection date | 2010-06-30 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.9795 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 92.970, 97.190, 191.990 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.338 - 2.400 |
R-factor | 0.1793 |
Rwork | 0.178 |
R-free | 0.21330 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | ENSEMBL OF PDB ENTRIES 2V62 2JII and 1CKJ |
RMSD bond length | 0.009 |
RMSD bond angle | 0.970 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.3.16) |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.338 | 46.338 | 2.530 |
High resolution limit [Å] | 2.400 | 7.590 | 2.400 |
Rmerge | 0.032 | 0.548 | |
Number of reflections | 67821 | ||
<I/σ(I)> | 7.8 | 16.6 | 1.4 |
Completeness [%] | 98.9 | 96.5 | 98.6 |
Redundancy | 3.5 | 3.5 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277 | 0.2m K/Na(tartrate), 20% PEG 3350, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 277K |