6H2A
Structure of S70A BlaC from Mycobacterium tuberculosis obtained from crystals produced in the presence of DTT
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-11-07 |
| Detector | DECTRIS EIGER R 4M |
| Wavelength(s) | 0.9677 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 108.864, 108.864, 260.577 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.730 - 2.540 |
| R-factor | 0.22945 |
| Rwork | 0.228 |
| R-free | 0.25634 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2gdn |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.757 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.730 | 2.630 |
| High resolution limit [Å] | 2.540 | 2.540 |
| Rpim | 0.034 | 0.490 |
| Number of reflections | 714649 | 71706 |
| <I/σ(I)> | 18.9 | 1.7 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 13.6 | 14.1 |
| CC(1/2) | 0.999 | 0.701 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 0.1 M Tris-HCl, pH 7.0 1.7 M NH4H2PO4 |
