3QTI
c-Met Kinase in Complex with NVP-BVU972
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-04-02 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.00 |
Spacegroup name | P 1 |
Unit cell lengths | 42.690, 47.100, 81.200 |
Unit cell angles | 103.94, 102.58, 90.04 |
Refinement procedure
Resolution | 39.390 - 2.000 |
R-factor | 0.1841 |
Rwork | 0.183 |
R-free | 0.21350 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 0.990 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.16) |
Phasing software | PHASER |
Refinement software | BUSTER-TNT (BUSTER 2.9.7) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 44.339 | 44.339 | 2.110 |
High resolution limit [Å] | 2.000 | 6.330 | 2.000 |
Rmerge | 0.036 | 0.432 | |
Number of reflections | 38882 | ||
<I/σ(I)> | 9.1 | 15 | 1.8 |
Completeness [%] | 96.5 | 96.2 | 95.9 |
Redundancy | 3.9 | 3.8 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | Equal Volumes Protein and a Reservoir Solution composed of 100 mM Hepes pH 7.5, 16% PEG 4000, 8% isopropanol, and 3 mM TCEP were mixed with microseeds., VAPOR DIFFUSION, HANGING DROP, temperature 291K |