5XQY
Structure of monomeric mutant of REI immunoglobulin light chain variable domain crystallized at pH 8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-05-13 |
| Detector | RAYONIX MX-225 |
| Wavelength(s) | 1.000000 |
| Spacegroup name | P 4 |
| Unit cell lengths | 130.046, 130.046, 90.055 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 58.158 - 2.900 |
| R-factor | 0.2336 |
| Rwork | 0.231 |
| R-free | 0.28470 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2q20 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.948 |
| Data reduction software | DIALS (v1.4.4) |
| Data scaling software | Aimless (v0.5.31) |
| Phasing software | PHASER (v2.7.17) |
| Refinement software | PHENIX (v1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 58.160 | 3.040 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.086 | 0.594 |
| Rpim | 0.033 | 0.227 |
| Number of reflections | 33511 | 4442 |
| <I/σ(I)> | 23.6 | 5.4 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 15.4 | 15.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277.15 | 0.1M Tris-HCl pH 8.0, 2.0M AMMONIUM PHOSPHATE MONOBASIC |
