3UFI
Crystal structure of a putative cell adhesion protein (BACOVA_04980) from Bacteroides ovatus ATCC 8483 at 2.18 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-10-15 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 63 |
Unit cell lengths | 176.660, 176.660, 51.171 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.278 - 2.180 |
R-factor | 0.1788 |
Rwork | 0.178 |
R-free | 0.20190 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.140 |
Data reduction software | XDS |
Data scaling software | XSCALE (December 6, 2010) |
Phasing software | SHELX |
Refinement software | BUSTER-TNT (2.10.0) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 44.278 | 44.280 | 2.260 |
High resolution limit [Å] | 2.180 | 4.680 | 2.180 |
Rmerge | 0.131 | 0.064 | 1.080 |
Number of reflections | 48085 | 5027 | 4854 |
<I/σ(I)> | 11.34 | 27.1 | 2.1 |
Completeness [%] | 99.9 | 99.8 | 99.7 |
Redundancy | 7.74 | 7.71 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9 | 277 | 2.4M ammonium sulfate, 0.1M Bicine pH 9.0, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K |