2X9Q
Structure of the Mycobacterium tuberculosis protein, Rv2275, demonstrates that cyclodipeptide synthetases are related to type I tRNA-Synthetases.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X9A |
Synchrotron site | NSLS |
Beamline | X9A |
Temperature [K] | 193 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 71.090, 75.060, 140.360 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 70.180 - 2.020 |
R-factor | 0.18142 |
Rwork | 0.180 |
R-free | 0.21047 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.027 |
RMSD bond angle | 2.047 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.000 | 2.120 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.070 | 0.410 |
Number of reflections | 49827 | |
<I/σ(I)> | 13.5 | 3.6 |
Completeness [%] | 98.9 | 95.9 |
Redundancy | 5.3 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.75 | 12-15% (W/V) PEG 8000, 1M LICL, 100 MM TRIS/BICINE, PH 8.75 |