4NKM
Crystal structure of engineered anti-EE scFv antibody fragment
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-06-27 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 103.265, 92.257, 142.708 |
Unit cell angles | 90.00, 110.86, 90.00 |
Refinement procedure
Resolution | 46.100 - 3.710 |
R-factor | 0.2645 |
Rwork | 0.264 |
R-free | 0.28200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3nn8 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.867 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.100 | 3.840 |
High resolution limit [Å] | 3.710 | 3.710 |
Rmerge | 0.221 | |
Number of reflections | 11363 | |
<I/σ(I)> | 11.85 | 4.3 |
Completeness [%] | 100.0 | 82.24 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 277.15 | Crystals of 3D5/EE_48.K (7.5mg/ml in HBS) were grown at 4 C with 0.1M Tris pH 8.5, 0.2M Li2(SO4), 3% 6-aminohexanoic acid, 24% PEG 8000; crystals appeared in 4-5 days, VAPOR DIFFUSION, SITTING DROP, temperature 277.15K |