6L7D
Mycobacterium tuberculosis enolase mutant - S42A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2019-10-23 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.54178 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 139.315, 139.315, 90.049 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.880 - 3.000 |
R-factor | 0.2068 |
Rwork | 0.205 |
R-free | 0.24280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6kkc |
RMSD bond length | 0.003 |
RMSD bond angle | 1.240 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 3.110 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.127 | |
Number of reflections | 8857 | 870 |
<I/σ(I)> | 2.19 | |
Completeness [%] | 97.1 | |
Redundancy | 8.4 | |
CC(1/2) | 0.722 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | PEG 3350, ammonium acetate, Bis-tris |