5I2X
Crystal Structure of TPP1 K170del
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2014-06-16 |
Detector | MAR scanner 300 mm plate |
Wavelength(s) | 1.03829 |
Spacegroup name | I 41 2 2 |
Unit cell lengths | 119.026, 119.026, 170.778 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.000 |
R-factor | 0.1954 |
Rwork | 0.192 |
R-free | 0.22560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2i46 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.988 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0071) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 3.110 |
High resolution limit [Å] | 3.000 | 6.460 | 3.000 |
Rmerge | 0.148 | 0.067 | 0.485 |
Rmeas | 0.160 | ||
Rpim | 0.059 | ||
Total number of observations | 86466 | ||
Number of reflections | 12617 | ||
<I/σ(I)> | 7.1 | ||
Completeness [%] | 99.7 | 97.8 | 100 |
Redundancy | 6.9 | 6.2 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 289 | 3.6 M sodium formate, 100 mM Tris-Cl pH 8.0 |