5IIC
Crystal structure of red abalone VERL repeat 3 at 2.9 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-01-25 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.97625 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 58.330, 81.640, 111.630 |
Unit cell angles | 90.00, 99.60, 90.00 |
Refinement procedure
Resolution | 47.017 - 2.900 |
R-factor | 0.2545 |
Rwork | 0.251 |
R-free | 0.30960 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3set 3SEX and 4WRN |
RMSD bond length | 0.003 |
RMSD bond angle | 0.548 |
Data reduction software | XDS (20141118) |
Data scaling software | XDS (20141118) |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.805 | 3.004 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.173 | 1.300 |
Number of reflections | 22737 | |
<I/σ(I)> | 7.32 | 1.2 |
Completeness [%] | 98.0 | 97 |
Redundancy | 4 | 4 |
CC(1/2) | 0.990 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 20% PEG 4000, 20% isopropanol, 0.1M tri-sodium citrate |