5YPY
Crystal structure of IlvN. Val-1c
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-03-30 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.9537 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 110.519, 74.510, 63.270 |
Unit cell angles | 90.00, 97.58, 90.00 |
Refinement procedure
Resolution | 44.250 - 1.966 |
R-factor | 0.2001 |
Rwork | 0.198 |
R-free | 0.24190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2lvw |
RMSD bond length | 0.017 |
RMSD bond angle | 1.430 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (v1.13-2998-000) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 62.720 | 2.010 |
High resolution limit [Å] | 1.966 | 1.970 |
Rmerge | 0.107 | 0.666 |
Rmeas | 0.893 | |
Rpim | 0.096 | 0.589 |
Number of reflections | 36151 | 2421 |
<I/σ(I)> | 5.2 | 1.1 |
Completeness [%] | 99.7 | 95.7 |
Redundancy | 4 | 3.5 |
CC(1/2) | 0.993 | 0.764 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 6.5 | 288 | 1.6M Sodium citrate tribasic dihydrate, pH 6.5 |