6CWG
Ricin catalytic subunit bound go A9 VHH antibody
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-06-23 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.979 |
Spacegroup name | P 31 |
Unit cell lengths | 76.654, 76.654, 134.331 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.215 - 2.600 |
R-factor | 0.2259 |
Rwork | 0.223 |
R-free | 0.26180 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.710 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.640 |
High resolution limit [Å] | 2.600 | 7.050 | 2.600 |
Rmerge | 0.091 | 0.040 | 0.607 |
Rmeas | 0.100 | 0.044 | 0.678 |
Rpim | 0.042 | 0.018 | 0.300 |
Total number of observations | 150691 | ||
Number of reflections | 26739 | 1346 | 1318 |
<I/σ(I)> | 9.1 | ||
Completeness [%] | 100.0 | 99.9 | 99.7 |
Redundancy | 5.6 | 5.7 | 5 |
CC(1/2) | 0.998 | 0.949 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 10.5 | 295 | 200 mM Lithiuim sulfate, 100 mM CAPS pH 10.5, 2 M Ammonium sulfate |