6LEB
Staphylococcus aureus surface protein SdrC mutant-P366H
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-07-01 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9778 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 63.734, 87.130, 63.974 |
Unit cell angles | 90.00, 97.99, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.540 |
R-factor | 0.1285 |
Rwork | 0.126 |
R-free | 0.17740 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3irp |
RMSD bond length | 0.027 |
RMSD bond angle | 2.255 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.520 |
High resolution limit [Å] | 1.490 | 4.040 | 1.490 |
Rmerge | 0.096 | 0.550 | |
Rmeas | 0.571 | ||
Rpim | 0.152 | 0.604 | |
Number of reflections | 100843 | 3088 | 2773 |
<I/σ(I)> | 3.1 | ||
Completeness [%] | 99.8 | 100 | 96.7 |
Redundancy | 12.4 | 13.1 | 7.4 |
CC(1/2) | 0.933 | 0.154 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.08 M Magnesium formate dihydrate, 25% w/v Polyethylene glycol 3,350 |