5BYV
Crystal structure of MSM-13, a putative T1-like thiolase from Mycobacterium smegmatis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2014-07-08 |
Detector | MAR scanner 300 mm plate |
Wavelength(s) | 0.95 |
Spacegroup name | P 61 |
Unit cell lengths | 190.959, 190.959, 264.681 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.193 - 2.162 |
R-factor | 0.1707 |
Rwork | 0.169 |
R-free | 0.20000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4zec |
RMSD bond length | 0.009 |
RMSD bond angle | 1.222 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 45.193 |
High resolution limit [Å] | 2.160 |
Number of reflections | 290242 |
<I/σ(I)> | 12.2 |
Completeness [%] | 99.9 |
Redundancy | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 6 | 293 | 45% PEG 200, 0.1M MES monohydrate pH 6.0, 0.07M calcium chloride dihydrate |