6XAM
Crystal structure of NzeB in complex with cyclo-(L-Trp-L-homoalanine)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-03-15 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.03 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 55.607, 56.203, 56.058 |
| Unit cell angles | 90.00, 101.83, 90.00 |
Refinement procedure
| Resolution | 39.261 - 1.481 |
| R-factor | 0.1894 |
| Rwork | 0.188 |
| R-free | 0.22120 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6xai |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.261 | 1.534 |
| High resolution limit [Å] | 1.481 | 1.481 |
| Rmerge | 0.030 | 0.303 |
| Rmeas | 0.032 | 0.393 |
| Number of reflections | 50302 | 2484 |
| <I/σ(I)> | 31.27 | 2.31 |
| Completeness [%] | 89.3 | 44.42 |
| Redundancy | 6.2 | 2 |
| CC(1/2) | 1.000 | 0.834 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 23% PEG 3350, 100 mM DL-malic acid, 2.5% ethylene glycol |
